A0A3Q0KVD1_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A3Q0KVD1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 969 aa.

						>A0A3Q0KVD1_SCHMA|A0A3Q0KVD1
MLEAYLYIGSLERRKHIKSDSIFVFNPYIHNEPTTEGPNVHYDDLGVLPLKEYTKTNEMLETDQTTICASAIYVNQIPNMSLDESERLKEFTNESSHSSDTTTHLKDTCSPNCEIIPNKIPLQSMDGSFAQTTKINELYPRFDSVDGLSAKSRQSDSLYNSGSVEPVSLPVFEIPAQIPHTGTGSSLSKRFVMKDDSVSSSIMRYHSVCNESTQKIHTIPKIEEWSAIEVDSHHNEYTRRFSVKSAPEDVRHCVRIRPKRSATKKWFKFRLPKSSLNLKSHIGNKLSTAEEEIFESKSVFMETSSQGKTSILGKRENNGSDGVDGNLFPPIPNRKLSTNMINKSDERLHHSPLINLCAQLFPRLFRQNESSSNYLSNGFLPRIQRLSTNTFRRVKRKKRTARRLDKISNQASVEEQEEKFHLIPLYTKRRPSRFSHYGNVGLFENKGNLLVKQEEHNLLNRSSHSSDKEFSENDSFNTSIKNSKTWPTGSLTSKVAGEIACLYRGLIETIGSDKLIESTSQTWSHFTHRKLQSSTINNVPSFNWNSVRIQYDKSNKSTYNFPLNDLSAMRYSTTNHPKVTDEIVSSREVTDEALKNTTISSKTNQANKSSTKNESFLNKVTQNLEDCAVRNSSNNSELQSELKVEKSNHSSTNDNTHYPYAKYVADMIDALSERLMGKISEDDLELRFQILEAEASKAAKHKTAQSVKRERFYSVSNEAENLRCQNSLQNTTRGNSSSDENILNKIAERKELKNRRCHSVTDFFVTTKPSDLQNVSSLESSQRSLKYSCLEQVKRLQLRNKLTITEDLLSRLVNHTNYPNFEADILDLLGRQPNWHRIAILYYLTRCSVRHILNLHIEKLETLQESTSGSSILRQSININSDSEEIDESYLQSSGSHIYHSSSKLPQSNLYPSNSTYETIIRDTGQCRANIGRIKDYTITFFTRWYADWVYKRGGWQSVIEETEDSELD
					

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	26	Very low	29.6	Very low	203 Å²	203	154.1 Å²	154.1	100%	1	80%	0.8	S	S	*	*				0	-67.5	0	-96.8	-177	75.2	0	0	111.2	A4	M1-A4 PolarHBondContact O-N 3.44Å
2	L	27.2	Very low	29.4	Very low	158 Å²	158	155.3 Å²	155.3	83%	0.827	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-71.8	-33.3	176.9	-87.8	161.6	0	0	0	113.1	A4 Y5	L2-A4 PolarHBondContact O-N 2.89Å; L2-Y5 PolarHBondContact O-N 3.45Å
3	E	29.4	Very low	29.4	Very low	192 Å²	192	160.3 Å²	160.3	90%	0.897	80%	0.802	S	S	*	*	G	3₁₀ helix	trans	-67.1	-1.1	174.3	-64.4	144	129.1	0	0	114.3
4	A	35.8	Very low	29.1	Very low	83 Å²	83	164.6 Å²	164.6	69%	0.686	80%	0.804	S	S	*	*	G	3₁₀ helix	trans	-102.6	5.5	179.4	0	0	0	0	0	113.6	M1 L2	M1-A4 PolarHBondContact O-N 3.44Å; L2-A4 PolarHBondContact O-N 2.89Å
5	Y	31.5	Very low	29.1	Very low	202 Å²	202	165.9 Å²	165.9	79%	0.792	80%	0.804	S	S	*	*	S	Bend	trans	-118.5	-0.5	-167.4	-121.7	-78.6	0	0	0	115.8	L2	L2-Y5 PolarHBondContact O-N 3.45Å
6	L	33.3	Very low	29	Very low	160 Å²	160	165 Å²	165	84%	0.838	80%	0.797	S	S	*	*			trans	-134.2	42.9	-177.5	-71.4	174.6	0	0	0	112.5	I8	L6-I8 PolarHBondContact O-N 2.97Å
7	Y	27.2	Very low	29	Very low	224 Å²	224	164.1 Å²	164.1	88%	0.878	80%	0.796	S	S	*	*			trans	-96	75.1	171.2	-154.4	-85.8	0	0	0	110
8	I	33.8	Very low	29.1	Very low	160 Å²	160	165.7 Å²	165.7	82%	0.821	80%	0.798	S	S	*	*			trans	-100	89.3	171.2	-56.8	-179.1	0	0	0	108	L6	L6-I8 PolarHBondContact O-N 2.97Å
9	G	26.3	Very low	29.1	Very low	43 Å²	43	161.6 Å²	161.6	44%	0.443	79%	0.789	S	S	.	*			trans	-81.4	-173.3	160.3	0	0	0	0	0	111.4
10	S	27.6	Very low	29	Very low	119 Å²	119	160.5 Å²	160.5	83%	0.832	79%	0.786	S	S	*	*			trans	55.3	92.5	172.4	59.2	0	0	0	0	117
11	L	27.2	Very low	29.1	Very low	151 Å²	151	158.8 Å²	158.8	79%	0.791	79%	0.79	S	S	*	*				-144.9	93	129.1	-149.7	83.8	0	0	0	110.8
12	E	27	Very low	29	Very low	168 Å²	168	155.5 Å²	155.5	79%	0.785	78%	0.776	S	S	*	*			trans	-68.9	137.8	162.3	-70.7	-175.3	94.6	0	0	110
13	R	29.3	Very low	29	Very low	221 Å²	221	158.3 Å²	158.3	83%	0.834	78%	0.782	S	S	*	*			trans	-156.6	114.3	149.2	-132.3	171.6	-80.3	-158	-1.6	112.3
14	R	25.7	Very low	28.7	Very low	220 Å²	220	154.2 Å²	154.2	83%	0.83	77%	0.769	S	S	*	*			trans	-77.8	143.8	172.6	-55.7	171.6	179.9	177.6	-2.5	110.3
15	K	28.4	Very low	28.3	Very low	184 Å²	184	160.3 Å²	160.3	80%	0.8	78%	0.78	S	S	*	*				165.8	138	118	-93.9	179.4	168.5	-172.3	0	116.5
16	H	28.8	Very low	28	Very low	152 Å²	152	156.4 Å²	156.4	70%	0.704	77%	0.774	S	S	*	*			trans	55.4	90.3	149.3	-64.8	-68	0	0	0	123.3
17	I	28.9	Very low	27.7	Very low	150 Å²	150	153.6 Å²	153.6	77%	0.769	77%	0.765	S	S	*	*				27.3	120.5	108.5	-53.9	167.9	0	0	0	118.8
18	K	31.1	Very low	27.8	Very low	192 Å²	192	153.4 Å²	153.4	84%	0.835	76%	0.764	S	S	*	*				-168	123.9	123.4	-104	-175.1	178.9	-170.5	0	108.2
19	S	28.9	Very low	27.7	Very low	89 Å²	89	152.3 Å²	152.3	62%	0.622	76%	0.759	S	S	*	*				74.3	130.4	88.6	-82.2	0	0	0	0	113.3
20	D	26.3	Very low	27.7	Very low	139 Å²	139	158.7 Å²	158.7	74%	0.743	78%	0.776	S	S	*	*			cis	-149.4	149.3	5.7	-70.4	-53.5	0	0	0	113
21	S	31.4	Very low	27.9	Very low	124 Å²	124	159.9 Å²	159.9	87%	0.867	77%	0.774	S	S	*	*			trans	-176.6	146.5	135.4	27.2	0	0	0	0	109.9
22	I	24.7	Very low	27.9	Very low	135 Å²	135	160.9 Å²	160.9	69%	0.692	77%	0.774	S	S	*	*			trans	-128.1	136.8	-167.8	-63.8	163	0	0	0	109.1	V24	I22-V24 HydrophobicContact CG2-CG2 3.95Å
23	F	26.3	Very low	28.2	Very low	217 Å²	217	157.8 Å²	157.8	95%	0.952	77%	0.769	S	S	*	*			trans	-143.2	150.6	138.5	-97.5	-68	0	0	0	110.9
24	V	23.7	Very low	28.2	Very low	105 Å²	105	153.1 Å²	153.1	64%	0.636	77%	0.765	S	S	*	*			trans	-102.3	139.4	-154.8	176.5	0	0	0	0	112.2	I22	I22-V24 HydrophobicContact CG2-CG2 3.95Å
25	F	25.7	Very low	28.4	Very low	211 Å²	211	148.4 Å²	148.4	93%	0.925	76%	0.76	S	S	*	*			trans	-132.1	147.3	145.8	-110	-88	0	0	0	109.9	P27	F25-P27 WeakPolarHBondContact O-CD 3.46Å
26	N	25.9	Very low	28.5	Very low	121 Å²	121	148.7 Å²	148.7	65%	0.647	77%	0.765	S	S	*	*			trans	-100.5	113.7	-153.6	-169.7	22.4	0	0	0	113.2
27	P	28.1	Very low	28.5	Very low	101 Å²	101	144.7 Å²	144.7	66%	0.656	76%	0.764	S	S	*	*			trans	-88.6	113.1	176.1	33.5	-29.7	0	0	0	110.9	F25	F25-P27 WeakPolarHBondContact O-CD 3.46Å
28	Y	28.7	Very low	28.5	Very low	220 Å²	220	143.8 Å²	143.8	86%	0.863	77%	0.768	S	S	*	*			trans	-70.8	141.6	175.4	-123.1	-93.3	0	0	0	111.8
29	I	31.7	Very low	28.5	Very low	137 Å²	137	142.3 Å²	142.3	70%	0.703	77%	0.77	S	S	*	*			trans	-90.2	132.9	-161	-63.6	169	0	0	0	111.6
30	H	27.1	Very low	28.5	Very low	177 Å²	177	143.7 Å²	143.7	82%	0.819	77%	0.774	S	S	*	*			trans	-86.4	111.5	173.1	-142.3	-59.7	0	0	0	109.9
31	N	31.5	Very low	28.6	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	78%	0.778	S	S	*	*			trans	-109.5	105.9	170.6	-76.9	-17.3	0	0	0	109.7
32	E	26.8	Very low	28.5	Very low	172 Å²	172	148.8 Å²	148.8	80%	0.804	77%	0.772	S	S	*	*			trans	-76.3	164.7	150.7	-86.8	-165	142.7	0	0	109.4
33	P	33.1	Very low	28.7	Very low	103 Å²	103	149.8 Å²	149.8	67%	0.669	78%	0.779	S	S	*	*			cis	-137.4	-167.7	19.7	39.9	-19.9	0	0	0	116.1
34	T	29.5	Very low	28.8	Very low	122 Å²	122	146.5 Å²	146.5	75%	0.748	77%	0.772	S	S	*	*			trans	84.2	118.5	157.3	53.6	0	0	0	0	121.1
35	T	30	Very low	29.1	Very low	121 Å²	121	149.7 Å²	149.7	74%	0.742	78%	0.784	S	S	*	*			trans	74	121.2	147.7	29.4	0	0	0	0	122
36	E	29.8	Very low	29.1	Very low	190 Å²	190	142.8 Å²	142.8	89%	0.888	77%	0.772	S	S	*	*			trans	75.7	141	146.7	-62.7	-178.7	-169.5	0	0	121
37	G	29.6	Very low	29.2	Very low	68 Å²	68	143.9 Å²	143.9	70%	0.701	78%	0.783	S	S	*	*			trans	96.6	101.8	163	0	0	0	0	0	117	N39	G37-N39 PolarHBondContact O-N 2.98Å
38	P	29.3	Very low	29.2	Very low	131 Å²	131	146.8 Å²	146.8	85%	0.851	79%	0.793	S	S	*	*			trans	-82.1	107.4	167.7	32.2	-30.3	0	0	0	110.6
39	N	30.9	Very low	29.1	Very low	161 Å²	161	142 Å²	142	86%	0.861	79%	0.788	S	S	*	*			trans	-125.9	139.1	165.5	-99.5	-29.5	0	0	0	110.5	G37	G37-N39 PolarHBondContact O-N 2.98Å
40	V	28.2	Very low	29.1	Very low	119 Å²	119	143.9 Å²	143.9	72%	0.721	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-95.4	119.9	-175.1	178.8	0	0	0	0	109.3	Y42	V40-Y42 HydrophobicContact CG1-CD2 3.91Å; V40-Y42 HydrophobicContact CG1-CE2 3.86Å
41	H	29.5	Very low	29.3	Very low	177 Å²	177	143.1 Å²	143.1	82%	0.819	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-101.1	130.5	161.9	-95.7	-81.9	0	0	0	110.1
42	Y	28.4	Very low	29.1	Very low	192 Å²	192	143.3 Å²	143.3	75%	0.753	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-93.7	131.1	163.9	-82.5	-105.8	0	0	0	108	V40	V40-Y42 HydrophobicContact CG1-CD2 3.91Å; V40-Y42 HydrophobicContact CG1-CE2 3.86Å
43	D	29.9	Very low	29.3	Very low	156 Å²	156	146.6 Å²	146.6	83%	0.834	80%	0.796	S	S	*	*			trans	-94.5	91	169	-76	-33.5	0	0	0	109.8	L45	D43-L45 PolarHBondContact O-N 3.25Å
44	D	27.5	Very low	29	Very low	149 Å²	149	147.9 Å²	147.9	80%	0.797	80%	0.802	S	S	*	*			trans	-78.4	96.7	172.2	-82.9	-46.6	0	0	0	111	G46	D44-G46 VanDerWaalsContact C-N 3.32Å; D44-G46 PolarHBondContact O-N 3.17Å; D44-G46 VanDerWaalsContact O-N 3.1Å
45	L	28.9	Very low	29.1	Very low	171 Å²	171	151.1 Å²	151.1	90%	0.895	81%	0.806	S	S	*	*			trans	-82.6	77.2	168.5	-80.2	171.3	0	0	0	111.1	D43	D43-L45 PolarHBondContact O-N 3.25Å
46	G	27.6	Very low	29.1	Very low	66 Å²	66	150.6 Å²	150.6	68%	0.68	80%	0.803	S	S	*	*			trans	-67.1	138.8	172.3	0	0	0	0	0	113	D44	D44-G46 VanDerWaalsContact C-N 3.32Å; D44-G46 PolarHBondContact O-N 3.17Å; D44-G46 VanDerWaalsContact O-N 3.1Å
47	V	26.4	Very low	29.2	Very low	144 Å²	144	148.5 Å²	148.5	87%	0.873	80%	0.797	S	S	*	*			trans	-89.3	108.9	175.6	178.3	0	0	0	0	109.5
48	L	28.6	Very low	29.2	Very low	163 Å²	163	152.9 Å²	152.9	85%	0.853	80%	0.8	S	S	*	*			trans	-89.3	129.4	174.3	-80.3	167.5	0	0	0	111.6	L50	L48-L50 PolarHBondContact O-N 2.83Å
49	P	27.5	Very low	29.1	Very low	118 Å²	118	154.2 Å²	154.2	77%	0.766	80%	0.797	S	S	*	*			trans	-84	110.6	173	32.3	-31.1	0	0	0	110.6	K51	P49-K51 PolarHBondContact O-N 3.23Å
50	L	31.4	Very low	29.1	Very low	177 Å²	177	152.5 Å²	152.5	93%	0.927	79%	0.787	S	S	*	*			trans	-84.7	100.7	-178.1	-161.3	76.3	0	0	0	112	L48	L48-L50 PolarHBondContact O-N 2.83Å
51	K	29.8	Very low	29.2	Very low	162 Å²	162	154.5 Å²	154.5	70%	0.704	79%	0.788	S	S	*	*			trans	-84.4	150.6	158.5	-97.6	-173.3	159.5	-130.3	0	110.7	P49	P49-K51 PolarHBondContact O-N 3.23Å
52	E	28.7	Very low	29.2	Very low	147 Å²	147	151.7 Å²	151.7	69%	0.687	78%	0.783	S	S	*	*			trans	39.4	98.1	147.1	-64.1	161.5	-140.1	0	0	118.1
53	Y	31.4	Very low	29.2	Very low	242 Å²	242	149.9 Å²	149.9	95%	0.949	79%	0.787	S	S	*	*			trans	-146	104.1	143.9	-106.8	-72.5	0	0	0	111.8
54	T	27	Very low	29	Very low	129 Å²	129	150.9 Å²	150.9	79%	0.791	79%	0.787	S	S	*	*			trans	-99.7	123.5	171	51.2	0	0	0	0	110.6
55	K	31.2	Very low	29.1	Very low	190 Å²	190	150.3 Å²	150.3	83%	0.826	79%	0.789	S	S	*	*			trans	177.4	148.8	132.1	-103.4	173.7	179.7	177.6	0	115.1
56	T	29.9	Very low	29	Very low	111 Å²	111	147.8 Å²	147.8	68%	0.681	78%	0.781	S	S	*	*			trans	55.2	95.3	146.3	55.8	0	0	0	0	120
57	N	31.4	Very low	29	Very low	145 Å²	145	152.3 Å²	152.3	78%	0.775	79%	0.787	S	S	*	*				146.4	142.5	115	-75.5	-4.1	0	0	0	110.7
58	E	30.4	Very low	28.8	Very low	160 Å²	160	151.1 Å²	151.1	75%	0.748	78%	0.784	S	S	*	*			cis	176.1	135.3	-25.6	-123.7	-170	156.1	0	0	103.3
59	M	27.5	Very low	28.7	Very low	160 Å²	160	148.2 Å²	148.2	79%	0.788	78%	0.784	S	S	*	*			trans	60.4	132	165.5	-57.6	-174.5	69.9	0	0	117.4
60	L	30.8	Very low	28.5	Very low	124 Å²	124	148.4 Å²	148.4	65%	0.649	79%	0.788	S	S	*	*			cis	-144.7	160.2	18.6	-77.9	97.1	0	0	0	111.9
61	E	30.1	Very low	28.2	Very low	162 Å²	162	144.2 Å²	144.2	76%	0.757	78%	0.779	S	S	*	*			trans	40.5	135.1	137.3	-59.7	176.1	166.6	0	0	121.4
62	T	28.5	Very low	28.1	Very low	117 Å²	117	144 Å²	144	72%	0.718	78%	0.783	S	S	*	*			cis	-160.3	171.1	-6.2	7.6	0	0	0	0	110.4
63	D	27.8	Very low	28	Very low	155 Å²	155	147.8 Å²	147.8	83%	0.829	79%	0.793	S	S	*	*			trans	57.1	82	159.5	-65.3	3	0	0	0	119.5
64	Q	27.2	Very low	27.8	Very low	176 Å²	176	142 Å²	142	82%	0.822	78%	0.783	S	S	*	*			trans	-120.7	137.7	150.7	-69.3	-169.3	8.4	0	0	111
65	T	28.7	Very low	27.9	Very low	137 Å²	137	143.2 Å²	143.2	84%	0.84	78%	0.784	S	S	*	*			trans	-130.1	53.6	174.9	43.4	0	0	0	0	112.5	I67	T65-I67 PolarHBondContact O-N 3.36Å
66	T	27.6	Very low	27.8	Very low	119 Å²	119	141.1 Å²	141.1	73%	0.73	78%	0.777	S	S	*	*			trans	-91.3	81	178.7	-36.7	0	0	0	0	111.1	C68	T66-C68 PolarHBondContact O-N 3.46Å
67	I	27.3	Very low	27.9	Very low	160 Å²	160	141.6 Å²	141.6	82%	0.821	78%	0.775	S	S	*	*			trans	-71.2	121.2	179.9	-63.4	177.4	0	0	0	110.5	T65	T65-I67 PolarHBondContact O-N 3.36Å
68	C	22.5	Very low	27.9	Very low	119 Å²	119	139.8 Å²	139.8	80%	0.804	77%	0.771	S	S	*	*			trans	-73.9	143.2	174.3	-71.5	0	0	0	0	112.1	T66	T66-C68 PolarHBondContact O-N 3.46Å
69	A	26.5	Very low	28	Very low	102 Å²	102	138.9 Å²	138.9	84%	0.843	77%	0.771	S	S	*	*			trans	-137.9	92.3	168.1	0	0	0	0	0	109.7
70	S	23.6	Very low	28.4	Very low	122 Å²	122	136.3 Å²	136.3	85%	0.853	76%	0.759	S	S	*	*			trans	-77.3	136.9	179.7	43.1	0	0	0	0	112.4
71	A	24.9	Very low	28.8	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	75%	0.747	S	S	*	*			trans	-164.6	146.4	160.2	0	0	0	0	0	112.5
72	I	28.2	Very low	29.2	Very low	157 Å²	157	131.8 Å²	131.8	81%	0.805	74%	0.744	S	S	*	*			trans	66.5	77.2	166.2	-41.5	177.1	0	0	0	115.6
73	Y	26.2	Very low	30.1	Very low	228 Å²	228	132 Å²	132	89%	0.894	74%	0.74	S	S	*	*			trans	-122.3	70.2	161.1	-134.8	-74.8	0	0	0	109.3
74	V	27	Very low	31.1	Very low	121 Å²	121	129.6 Å²	129.6	73%	0.733	72%	0.724	S	S	*	*			trans	-143.8	148.2	175.8	-171	0	0	0	0	108
75	N	28.2	Very low	31.6	Very low	153 Å²	153	123.3 Å²	123.3	82%	0.818	70%	0.7	S	S	*	*	S	Bend	trans	96	41.6	-175.5	-56.3	1.1	0	0	0	116.7
76	Q	30.1	Very low	32.5	Very low	146 Å²	146	122.1 Å²	122.1	68%	0.682	69%	0.685	S	S	*	*			trans	-135.6	165.2	153.2	-68.8	-167.1	-31.8	0	0	109.1
77	I	32.4	Very low	33.2	Very low	122 Å²	122	124.6 Å²	124.6	63%	0.626	68%	0.681	S	S	*	*			trans	72.8	75.6	-171.7	-44	168.7	0	0	0	114.6	N79	I77-N79 VanDerWaalsContact C-N 3.32Å; I77-N79 PolarHBondContact O-N 3.03Å
78	P	30.2	Very low	34	Very low	106 Å²	106	122.3 Å²	122.3	69%	0.688	67%	0.67	S	S	*	*			trans	-84.9	68.8	160.5	36.1	-32.3	0	0	0	110.7
79	N	33.4	Very low	35.1	Very low	142 Å²	142	122.1 Å²	122.1	76%	0.759	66%	0.655	S	S	*	*			trans	-169	32.1	171.5	-102.9	-18.5	0	0	0	114.6	I77	I77-N79 VanDerWaalsContact C-N 3.32Å; I77-N79 PolarHBondContact O-N 3.03Å
80	M	35.7	Very low	35.8	Very low	106 Å²	106	123.7 Å²	123.7	52%	0.522	65%	0.645	S	S	.	*			trans	-84.8	146.9	167.7	-117.1	179.7	-69.8	0	0	110.6	E84 L88	M80-E84 HydrophobicContact CG-CB 4.42Å; M80-E84 HydrophobicContact SD-CB 4.45Å; M80-L88 HydrophobicContact SD-CD1 4.38Å
81	S	38.6	Very low	36.4	Very low	57 Å²	57	127 Å²	127	40%	0.399	64%	0.644	S	S	.	*			trans	-69.8	157.1	175.5	68.7	0	0	0	0	111.7	D83 E84 S85	S81-D83 VanDerWaalsContact C-N 3.33Å; S81-D83 PolarHBondContact O-N 3.5Å; S81-E84 PolarHBondContact O-N 2.83Å; S81-E84 WeakPolarHBondContact OG-CG 3.36Å; S81-E84 PolarHBondContact OG-N 3.27Å; S81-S85 PolarHBondContact O-N 2.98Å
82	L	39.4	Very low	37.1	Very low	133 Å²	133	127.8 Å²	127.8	70%	0.696	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-39.7	-177.3	-146.6	152.1	0	0	0	110.9	E84 S85 E86	L82-E84 PolarHBondContact O-N 3.49Å; L82-S85 WeakPolarHBondContact O-CB 3.42Å; L82-S85 PolarHBondContact O-N 3.34Å; L82-S85 PolarHBondContact O-OG 2.69Å; L82-E86 HydrophobicContact CD2-CG 4.47Å; L82-E86 PolarHBondContact O-N 3.17Å
83	D	47	Very low	37.3	Very low	121 Å²	121	126.8 Å²	126.8	65%	0.647	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.4	-51.6	172.3	-84.9	-13.7	0	0	0	113.1	S81 S85 E86 R87	S81-D83 VanDerWaalsContact C-N 3.33Å; S81-D83 PolarHBondContact O-N 3.5Å; D83-S85 PolarHBondContact O-N 3.29Å; D83-E86 PolarHBondContact O-N 3.36Å; D83-R87 WeakPolarHBondContact O-CG 3.43Å; D83-R87 PolarHBondContact O-N 3.19Å
84	E	47.7	Very low	37.6	Very low	105 Å²	105	124.9 Å²	124.9	49%	0.491	64%	0.636	S	S	.	*	H	α-helix	trans	-65.3	-27.6	-178.3	-71.3	-177.8	141.9	0	0	112	M80 S81 L82 E86 L88	M80-E84 HydrophobicContact CG-CB 4.42Å; M80-E84 HydrophobicContact SD-CB 4.45Å; S81-E84 PolarHBondContact O-N 2.83Å; S81-E84 WeakPolarHBondContact OG-CG 3.36Å; S81-E84 PolarHBondContact OG-N 3.27Å; L82-E84 PolarHBondContact O-N 3.49Å; E84-E86 VanDerWaalsContact C-N 3.27Å; E84-E86 PolarHBondContact O-N 2.88Å; E84-L88 WeakPolarHBondContact O-CB 3.4Å; E84-L88 PolarHBondContact O-N 3.45Å
85	S	39.4	Very low	37.8	Very low	45 Å²	45	124.4 Å²	124.4	32%	0.315	64%	0.638	S	S	.	*	H	α-helix	trans	-72.6	-14.8	173.2	91.3	0	0	0	0	114.3	S81 L82 D83 K89	S81-S85 PolarHBondContact O-N 2.98Å; L82-S85 WeakPolarHBondContact O-CB 3.42Å; L82-S85 PolarHBondContact O-N 3.34Å; L82-S85 PolarHBondContact O-OG 2.69Å; D83-S85 PolarHBondContact O-N 3.29Å; S85-K89 WeakPolarHBondContact O-CD 3.5Å; S85-K89 WeakPolarHBondContact O-CE 3.42Å; S85-K89 WeakPolarHBondContact O-CG 3.46Å; S85-K89 PolarHBondContact O-NZ 2.89Å
86	E	46	Very low	37.8	Very low	111 Å²	111	122.3 Å²	122.3	52%	0.519	64%	0.636	S	S	.	*	H	α-helix	trans	-99.9	-40.1	175.1	-59.6	-150	125.9	0	0	111.6	L82 D83 E84 L88 K89 E90	L82-E86 HydrophobicContact CD2-CG 4.47Å; L82-E86 PolarHBondContact O-N 3.17Å; D83-E86 PolarHBondContact O-N 3.36Å; E84-E86 VanDerWaalsContact C-N 3.27Å; E84-E86 PolarHBondContact O-N 2.88Å; E86-L88 PolarHBondContact O-N 3.42Å; E86-K89 WeakPolarHBondContact O-CA 3.16Å; E86-K89 WeakPolarHBondContact O-CB 3.47Å; E86-K89 PolarHBondContact O-N 3.25Å; E86-E90 PolarHBondContact O-N 3.34Å; E86-E90 VanDerWaalsContact O-N 3.17Å
87	R	43	Very low	37.9	Very low	171 Å²	171	123.5 Å²	123.5	65%	0.645	64%	0.641	S	S	*	*	H	α-helix	trans	-60.5	-31.3	174.3	-61.5	-178	85.3	-172.5	6.7	112.6	D83 K89 F91	D83-R87 WeakPolarHBondContact O-CG 3.43Å; D83-R87 PolarHBondContact O-N 3.19Å; R87-K89 VanDerWaalsContact C-N 3.3Å; R87-K89 PolarHBondContact O-N 3.28Å; R87-F91 PolarHBondContact O-N 3.13Å
88	L	44.3	Very low	37.7	Very low	112 Å²	112	122 Å²	122	59%	0.586	64%	0.641	S	S	*	*	H	α-helix	trans	-74	-12.9	171.5	-80.7	166.6	0	0	0	114.6	M80 E84 E86	M80-L88 HydrophobicContact SD-CD1 4.38Å; E84-L88 WeakPolarHBondContact O-CB 3.4Å; E84-L88 PolarHBondContact O-N 3.45Å; E86-L88 PolarHBondContact O-N 3.42Å
89	K	44.7	Very low	37.7	Very low	115 Å²	115	121.7 Å²	121.7	50%	0.5	64%	0.641	S	S	.	*	H	α-helix	trans	-89.7	-29.5	172	-63.2	172.8	-169.7	124.4	0	112.3	S85 E86 R87 T92 N93	S85-K89 WeakPolarHBondContact O-CD 3.5Å; S85-K89 WeakPolarHBondContact O-CE 3.42Å; S85-K89 WeakPolarHBondContact O-CG 3.46Å; S85-K89 PolarHBondContact O-NZ 2.89Å; E86-K89 WeakPolarHBondContact O-CA 3.16Å; E86-K89 WeakPolarHBondContact O-CB 3.47Å; E86-K89 PolarHBondContact O-N 3.25Å; R87-K89 VanDerWaalsContact C-N 3.3Å; R87-K89 PolarHBondContact O-N 3.28Å; K89-T92 PolarHBondContact O-OG1 3.01Å; K89-N93 PolarHBondContact O-ND2 2.85Å
90	E	41.4	Very low	37.4	Very low	136 Å²	136	122 Å²	122	64%	0.636	64%	0.643	S	S	*	*	H	α-helix	trans	-64.4	-46.6	170.9	-68.8	-177.8	126.2	0	0	110.9	E86 T92 N93	E86-E90 PolarHBondContact O-N 3.34Å; E86-E90 VanDerWaalsContact O-N 3.17Å; E90-T92 PolarHBondContact O-N 3.21Å; E90-N93 PolarHBondContact O-N 2.78Å
91	F	37.4	Very low	37.1	Very low	190 Å²	190	123.4 Å²	123.4	83%	0.833	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	6.5	178.4	-94.1	-76.6	0	0	0	116.2	R87	R87-F91 PolarHBondContact O-N 3.13Å
92	T	39.2	Very low	36.5	Very low	106 Å²	106	126.3 Å²	126.3	65%	0.65	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	8.6	172.9	43.9	0	0	0	0	114.5	K89 E90	K89-T92 PolarHBondContact O-OG1 3.01Å; E90-T92 PolarHBondContact O-N 3.21Å
93	N	32.5	Very low	36.1	Very low	137 Å²	137	125.5 Å²	125.5	73%	0.733	67%	0.674	S	S	*	*	S	Bend	trans	-133.3	25.1	-178.3	-72.8	-73.6	0	0	0	115.8	K89 E90	K89-N93 PolarHBondContact O-ND2 2.85Å; E90-N93 PolarHBondContact O-N 2.78Å
94	E	32.7	Very low	35.2	Very low	187 Å²	187	127.2 Å²	127.2	87%	0.874	68%	0.678	S	S	*	*			trans	-126	143.3	164	-64	-165.6	146	0	0	110.3
95	S	30	Very low	34.3	Very low	112 Å²	112	128.9 Å²	128.9	78%	0.783	69%	0.689	S	S	*	*			cis	-136.4	169.9	1.6	64.8	0	0	0	0	111.6
96	S	28.4	Very low	33.9	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	71%	0.705	S	S	*	*			trans	-139.1	76.3	-176.3	54	0	0	0	0	114.3
97	H	33.2	Very low	33.2	Very low	170 Å²	170	134.1 Å²	134.1	79%	0.787	71%	0.71	S	S	*	*			trans	-139.2	128.4	168.3	-70.6	-64.9	0	0	0	108.5
98	S	27.9	Very low	32.7	Very low	92 Å²	92	131.5 Å²	131.5	64%	0.643	71%	0.713	S	S	*	*			cis	105.2	137.1	28.7	71.8	0	0	0	0	112.8
99	S	30.2	Very low	32	Very low	98 Å²	98	131.7 Å²	131.7	69%	0.685	72%	0.723	S	S	*	*			trans	63	108.9	172.9	53.6	0	0	0	0	120
100	D	26.8	Very low	31.4	Very low	150 Å²	150	131.5 Å²	131.5	80%	0.802	74%	0.736	S	S	*	*				45.5	133.2	117.9	-43.2	-37.9	0	0	0	119.8
101	T	30	Very low	31	Very low	135 Å²	135	130 Å²	130	83%	0.828	74%	0.738	S	S	*	*				-166.6	149.3	77.6	-64.9	0	0	0	0	114.1
102	T	25.8	Very low	30.8	Very low	117 Å²	117	128.1 Å²	128.1	72%	0.718	74%	0.737	S	S	*	*			trans	-57.8	170.8	-179	-34.2	0	0	0	0	117.9
103	T	30.8	Very low	30.4	Very low	116 Å²	116	128.2 Å²	128.2	71%	0.712	74%	0.74	S	S	*	*			trans	87.1	147.2	159.6	77.7	0	0	0	0	117.4
104	H	27.7	Very low	30.4	Very low	157 Å²	157	129.8 Å²	129.8	73%	0.727	74%	0.743	S	S	*	*			cis	-167.7	155.5	-14.9	-121.3	-48.6	0	0	0	112.5
105	L	29.3	Very low	30.3	Very low	140 Å²	140	127 Å²	127	73%	0.733	73%	0.733	S	S	*	*			trans	70.7	154.7	156.5	-55	158.6	0	0	0	116
106	K	30.3	Very low	30.3	Very low	151 Å²	151	128.1 Å²	128.1	66%	0.657	73%	0.729	S	S	*	*			cis	-163.9	158.8	-5.3	-125.7	173.3	161.7	-105.4	0	112.7
107	D	31	Very low	30.5	Very low	116 Å²	116	128.4 Å²	128.4	62%	0.62	73%	0.728	S	S	*	*			trans	59.1	148.3	147.5	-58.6	-21.8	0	0	0	119.5
108	T	32.6	Very low	30.5	Very low	116 Å²	116	127.1 Å²	127.1	71%	0.712	73%	0.727	S	S	*	*			cis	-159.6	153.7	6.6	-4.7	0	0	0	0	112.6
109	C	29.8	Very low	30.6	Very low	116 Å²	116	130.6 Å²	130.6	78%	0.784	73%	0.73	S	S	*	*			trans	63.3	146.5	153.1	-66.1	0	0	0	0	120.3
110	S	31.7	Very low	30.5	Very low	110 Å²	110	133 Å²	133	77%	0.769	73%	0.734	S	S	*	*			cis	-150.5	164.9	0.8	-101	0	0	0	0	112.5
111	P	34.3	Very low	30.8	Very low	104 Å²	104	130.9 Å²	130.9	68%	0.675	73%	0.728	S	S	*	*			trans	-117.7	171.3	-167.9	42.3	-32.9	0	0	0	116.2
112	N	33.1	Very low	30.6	Very low	152 Å²	152	132.1 Å²	132.1	81%	0.813	73%	0.729	S	S	*	*				179.1	162.7	122.3	-95.9	-14.5	0	0	0	115.8
113	C	30.8	Very low	30.9	Very low	107 Å²	107	136.1 Å²	136.1	72%	0.723	74%	0.739	S	S	*	*			trans	68.3	101.2	172.4	-56.7	0	0	0	0	116.6
114	E	31.3	Very low	30.7	Very low	170 Å²	170	135.7 Å²	135.7	79%	0.794	74%	0.742	S	S	*	*				79.2	143.8	70.5	-72.6	-174.6	168.7	0	0	113.2
115	I	31.3	Very low	30.9	Very low	130 Å²	130	136.8 Å²	136.8	67%	0.667	75%	0.749	S	S	*	*			cis	-166.1	151.8	4.6	-113.9	164.8	0	0	0	106.3
116	I	31.2	Very low	30.9	Very low	135 Å²	135	137.5 Å²	137.5	69%	0.692	75%	0.754	S	S	*	*			cis	-154.2	149.1	-13.2	-112.6	162.3	0	0	0	107.7
117	P	31.7	Very low	31	Very low	114 Å²	114	134.1 Å²	134.1	74%	0.74	76%	0.762	S	S	*	*			trans	-116.8	138.4	170.6	36.8	-27	0	0	0	115
118	N	33.5	Very low	30.9	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	77%	0.765	S	S	*	*			trans	-162.5	-174.9	165	-92.3	-50.4	0	0	0	112
119	K	28.8	Very low	30.6	Very low	166 Å²	166	137.5 Å²	137.5	72%	0.722	77%	0.774	S	S	*	*				175.8	146.7	-68.3	-133.6	178.1	175.1	176.9	0	110
120	I	29.1	Very low	30.7	Very low	147 Å²	147	136 Å²	136	75%	0.754	77%	0.769	S	S	*	*			trans	71.8	153.1	162.9	-43.6	151.1	0	0	0	112.2
121	P	32.8	Very low	30.6	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	77%	0.774	S	S	*	*				-136.3	-170.7	-61.6	44.1	-25.9	0	0	0	114.7
122	L	26.8	Very low	30.3	Very low	161 Å²	161	140.5 Å²	140.5	84%	0.843	78%	0.778	S	S	*	*			trans	-0.7	124.1	148.7	-62.7	164.1	0	0	0	119.7
123	Q	31.6	Very low	30.2	Very low	201 Å²	201	140.5 Å²	140.5	94%	0.939	78%	0.783	S	S	*	*				-171.2	167.9	117.9	-106.6	176.9	12.9	0	0	112.6
124	S	26.8	Very low	30.1	Very low	108 Å²	108	144 Å²	144	76%	0.755	79%	0.786	S	S	*	*			trans	-121.6	144.6	-176.5	54.8	0	0	0	0	111.7
125	M	31.2	Very low	30.2	Very low	179 Å²	179	143.9 Å²	143.9	88%	0.882	79%	0.79	S	S	*	*			trans	-167.4	158.9	151.5	-106.6	-62.5	169.8	0	0	111.3
126	D	30.1	Very low	30.1	Very low	156 Å²	156	142.9 Å²	142.9	83%	0.834	79%	0.785	S	S	*	*			trans	-75.5	160	-171.2	-57.7	-80.6	0	0	0	115.7
127	G	31.8	Very low	30	Very low	80 Å²	80	143.8 Å²	143.8	83%	0.825	79%	0.787	S	S	*	*			trans	-165.7	120	167.8	0	0	0	0	0	111
128	S	27.7	Very low	29.9	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	79%	0.79	S	S	*	*			trans	-137.1	158.1	-163.8	63	0	0	0	0	114.9
129	F	27	Very low	29.6	Very low	204 Å²	204	149.5 Å²	149.5	90%	0.895	80%	0.795	S	S	*	*			trans	63.6	159	178	-64.6	-82.3	0	0	0	115.6
130	A	31.2	Very low	29.9	Very low	84 Å²	84	147.1 Å²	147.1	69%	0.694	80%	0.797	S	S	*	*			cis	-129.7	-169.1	4.2	0	0	0	0	0	109.9
131	Q	31.5	Very low	29.7	Very low	187 Å²	187	149.6 Å²	149.6	87%	0.874	80%	0.797	S	S	*	*			cis	-156.3	171.2	14.9	-154.2	167.2	16.9	0	0	111.6
132	T	26.8	Very low	29.7	Very low	123 Å²	123	154.6 Å²	154.6	76%	0.755	81%	0.808	S	S	*	*			trans	-101.9	151.4	-169.3	54.2	0	0	0	0	115.6
133	T	30.7	Very low	30	Very low	151 Å²	151	152 Å²	152	93%	0.926	80%	0.795	S	S	*	*			trans	-148.3	152.7	146.7	16.9	0	0	0	0	112
134	K	28.8	Very low	29.9	Very low	180 Å²	180	147.8 Å²	147.8	78%	0.783	79%	0.788	S	S	*	*			trans	-122.3	154	-178.1	-59.1	176	179.5	178.1	0	110.8
135	I	33.9	Very low	30.2	Very low	169 Å²	169	148.8 Å²	148.8	87%	0.867	79%	0.789	S	S	*	*			trans	-161.6	110.6	142.6	-82.8	125.2	0	0	0	103.6
136	N	29	Very low	30.3	Very low	108 Å²	108	148 Å²	148	58%	0.578	79%	0.788	S	S	*	*				70.4	128.6	64.1	-90.1	46.5	0	0	0	116.2
137	E	28.9	Very low	30.4	Very low	155 Å²	155	144 Å²	144	72%	0.724	78%	0.784	S	S	*	*			trans	74	143.7	149.1	-73	160.1	-121.3	0	0	119
138	L	29.6	Very low	30.4	Very low	155 Å²	155	147.8 Å²	147.8	81%	0.812	79%	0.785	S	S	*	*			cis	-136.7	162.5	0.2	-86.1	113.6	0	0	0	112.3
139	Y	26.8	Very low	30.6	Very low	221 Å²	221	148.5 Å²	148.5	87%	0.867	79%	0.789	S	S	*	*			trans	-110.4	157.3	159.3	-99.6	-83.4	0	0	0	110.2
140	P	35.8	Very low	30.9	Very low	117 Å²	117	142.5 Å²	142.5	76%	0.76	78%	0.778	S	S	*	*			trans	-120.2	136.7	147.7	25.5	-9.7	0	0	0	112.8
141	R	25.6	Very low	31.2	Very low	199 Å²	199	148.4 Å²	148.4	75%	0.751	79%	0.788	S	S	*	*			trans	-93	162.1	165.6	-98.9	-168.6	-175.9	-174.9	7.7	110.6	D143	R141-D143 WeakPolarHBondContact CD-OD1 3.41Å; R141-D143 IonicContact CZ-OD1 3.79Å; R141-D143 IonicContact NE-OD1 3.32Å; R141-D143 IonicContact NH1-OD1 3.83Å; R141-D143 PolarHBondContact NH1-OD1 3.26Å
142	F	32.8	Very low	31.3	Very low	211 Å²	211	144.4 Å²	144.4	93%	0.925	78%	0.78	S	S	*	*			trans	-139.8	148.3	143.2	-86.2	-77.8	0	0	0	109.1
143	D	32.2	Very low	31.6	Very low	105 Å²	105	149 Å²	149	56%	0.561	78%	0.784	S	S	*	*			trans	-117.8	159.8	-161.3	-59	-84.6	0	0	0	114.4	R141	R141-D143 WeakPolarHBondContact CD-OD1 3.41Å; R141-D143 IonicContact CZ-OD1 3.79Å; R141-D143 IonicContact NE-OD1 3.32Å; R141-D143 IonicContact NH1-OD1 3.83Å; R141-D143 PolarHBondContact NH1-OD1 3.26Å
144	S	30.2	Very low	31.8	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	77%	0.774	S	S	*	*			trans	69.9	162.8	156.8	75.7	0	0	0	0	118.1
145	V	33.3	Very low	32.1	Very low	130 Å²	130	145.5 Å²	145.5	79%	0.788	77%	0.771	S	S	*	*			cis	-138.7	161.9	15.3	-169.6	0	0	0	0	111.7
146	D	32.3	Very low	32.2	Very low	161 Å²	161	145 Å²	145	86%	0.861	77%	0.77	S	S	*	*			trans	-71.9	172.2	-174.7	-55.6	-93.5	0	0	0	119.1
147	G	33	Very low	32.5	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	78%	0.778	S	S	*	*			trans	-177.5	54.3	175.4	0	0	0	0	0	121.2
148	L	32.2	Very low	32.8	Very low	161 Å²	161	146.2 Å²	146.2	84%	0.843	79%	0.789	S	S	*	*			trans	26.7	117.6	150.5	-60	172.1	0	0	0	121.5
149	S	31.6	Very low	32.9	Very low	112 Å²	112	148.5 Å²	148.5	78%	0.783	79%	0.788	S	S	*	*				82.1	154.1	89.9	98.9	0	0	0	0	116.6
150	A	33.7	Very low	33.2	Very low	78 Å²	78	144.6 Å²	144.6	65%	0.645	78%	0.782	S	S	*	*			cis	-162.7	161.3	5.4	0	0	0	0	0	114
151	K	36.3	Very low	33.2	Very low	209 Å²	209	144.9 Å²	144.9	91%	0.909	79%	0.787	S	S	*	*			trans	38.3	160.8	139.2	-59.4	171.8	-176.3	173.8	0	121.4
152	S	34	Very low	33.5	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	78%	0.783	S	S	*	*			cis	-152.3	154.6	17.8	60.5	0	0	0	0	112.9
153	R	33.9	Very low	33.5	Very low	219 Å²	219	134 Å²	134	83%	0.826	78%	0.778	S	S	*	*				44.5	150.7	104.9	-56.3	-170.4	171	-169.1	-2.8	117.8
154	Q	33.6	Very low	33.4	Very low	155 Å²	155	135.5 Å²	135.5	72%	0.724	79%	0.791	S	S	*	*			cis	-152.7	-174.9	13.4	-143.2	158.9	-69.8	0	0	112.9
155	S	35.6	Very low	33.4	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	79%	0.793	S	S	*	*			trans	-151.1	153.2	-176.1	56.3	0	0	0	0	112
156	D	35.2	Very low	33.4	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	79%	0.79	S	S	*	*			trans	-151.5	156.7	169.3	-85.1	-55	0	0	0	112.8
157	S	36.6	Very low	33.4	Very low	104 Å²	104	136.3 Å²	136.3	73%	0.727	79%	0.786	S	S	*	*			trans	-160.3	152.3	-179.3	62.3	0	0	0	0	113.3
158	L	33.5	Very low	33.4	Very low	183 Å²	183	138.2 Å²	138.2	96%	0.958	79%	0.788	S	S	*	*			trans	-143.2	162.1	172.7	-79	179.1	0	0	0	113.1
159	Y	32.3	Very low	33.2	Very low	204 Å²	204	137.5 Å²	137.5	80%	0.8	78%	0.784	S	S	*	*			trans	-116.4	154.3	-163.1	-91.4	-111.7	0	0	0	114.1
160	N	34.5	Very low	33.5	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	79%	0.786	S	S	*	*				150.5	143.3	109.8	-95.5	-33.3	0	0	0	116.3
161	S	33.8	Very low	33.2	Very low	123 Å²	123	138.9 Å²	138.9	86%	0.86	78%	0.783	S	S	*	*			trans	56	150.8	154.6	52.9	0	0	0	0	120.6
162	G	32.2	Very low	32.8	Very low	65 Å²	65	137.7 Å²	137.7	67%	0.67	78%	0.777	S	S	*	*			cis	176.4	169.8	-4.5	0	0	0	0	0	113.3
163	S	32.7	Very low	32.7	Very low	117 Å²	117	140.8 Å²	140.8	82%	0.818	78%	0.781	S	S	*	*			trans	56	111.5	165.5	60.1	0	0	0	0	123.1
164	V	30	Very low	32.3	Very low	136 Å²	136	137.9 Å²	137.9	82%	0.824	78%	0.78	S	S	*	*				39.3	113.2	127.7	-169.8	0	0	0	0	121.2
165	E	30.9	Very low	32.3	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	78%	0.784	S	S	*	*				-170.2	164.1	114.6	-101.4	-155.4	133.3	0	0	111.8
166	P	33.2	Very low	32	Very low	113 Å²	113	135.3 Å²	135.3	73%	0.734	78%	0.781	S	S	*	*			trans	-115.6	111.2	-166.9	36.8	-24.2	0	0	0	115.4
167	V	33.4	Very low	31.9	Very low	128 Å²	128	136 Å²	136	78%	0.776	78%	0.779	S	S	*	*			trans	-140	108.6	-177.5	-179.3	0	0	0	0	115.2
168	S	32.5	Very low	31.6	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	79%	0.785	S	S	*	*			trans	60.3	153.6	149.2	75.4	0	0	0	0	123.6
169	L	27.3	Very low	31.6	Very low	146 Å²	146	135.2 Å²	135.2	76%	0.764	77%	0.772	S	S	*	*			trans	-74.6	150.7	170.6	-69.1	149.4	0	0	0	112.8	V171	L169-V171 HydrophobicContact CB-CG2 4.1Å; L169-V171 HydrophobicContact CD1-CG2 4.45Å
170	P	37.3	Very low	31.7	Very low	125 Å²	125	134.2 Å²	134.2	81%	0.812	77%	0.774	S	S	*	*			trans	-85.4	125.3	143.3	32.9	-27	0	0	0	110.3
171	V	28.7	Very low	31.6	Very low	95 Å²	95	134 Å²	134	58%	0.576	78%	0.778	S	S	*	*			trans	-110.5	164.8	168.1	-174.6	0	0	0	0	107.8	L169	L169-V171 HydrophobicContact CB-CG2 4.1Å; L169-V171 HydrophobicContact CD1-CG2 4.45Å
172	F	26.7	Very low	31.6	Very low	183 Å²	183	131.7 Å²	131.7	80%	0.803	77%	0.774	S	S	*	*			trans	74.8	154.7	-179.7	-51.7	-80.1	0	0	0	113.8
173	E	32.6	Very low	31.7	Very low	168 Å²	168	135.9 Å²	135.9	79%	0.785	79%	0.787	S	S	*	*			cis	-144.7	161.5	12.4	-153.1	157	-125.8	0	0	112.2
174	I	25.5	Very low	31.7	Very low	158 Å²	158	133.5 Å²	133.5	81%	0.81	78%	0.78	S	S	*	*			trans	-108.8	108.7	174.7	-60.4	174.9	0	0	0	109.6
175	P	33.8	Very low	31.8	Very low	125 Å²	125	132.7 Å²	132.7	81%	0.812	78%	0.781	S	S	*	*			trans	-76.7	125	164.6	-11.6	28.5	0	0	0	110
176	A	30.1	Very low	31.8	Very low	80 Å²	80	129.2 Å²	129.2	66%	0.661	78%	0.776	S	S	*	*			trans	-96.3	167.9	174.3	0	0	0	0	0	112
177	Q	32.6	Very low	31.8	Very low	174 Å²	174	132.3 Å²	132.3	81%	0.813	79%	0.786	S	S	*	*			trans	74.6	96	162.9	-51.6	-175.8	24.5	0	0	118.6
178	I	30.5	Very low	31.5	Very low	164 Å²	164	131 Å²	131	84%	0.841	78%	0.782	S	S	*	*				66.2	141	112.1	-70	169.1	0	0	0	119.1
179	P	33.9	Very low	31.6	Very low	106 Å²	106	135.7 Å²	135.7	69%	0.688	79%	0.789	S	S	*	*			trans	-116.8	160.2	-147.5	40.6	-29.7	0	0	0	116.3
180	H	34.4	Very low	31.5	Very low	182 Å²	182	139.1 Å²	139.1	84%	0.843	79%	0.791	S	S	*	*			trans	-133	119.7	166.3	-87.2	-80.6	0	0	0	114.8
181	T	32.4	Very low	31.2	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	80%	0.798	S	S	*	*			trans	3.6	127.5	146.8	52.1	0	0	0	0	120.7
182	G	33.9	Very low	31.3	Very low	76 Å²	76	144.5 Å²	144.5	78%	0.784	80%	0.804	S	S	*	*			trans	-164.6	152.4	161.7	0	0	0	0	0	112.6
183	T	32.4	Very low	31.4	Very low	153 Å²	153	142.8 Å²	142.8	94%	0.939	80%	0.8	S	S	*	*			trans	-137.3	137.6	-172.1	47.8	0	0	0	0	114.9
184	G	33.2	Very low	31.3	Very low	66 Å²	66	145 Å²	145	68%	0.68	81%	0.807	S	S	*	*			trans	157.1	132.2	166.2	0	0	0	0	0	109.2
185	S	31.9	Very low	31.6	Very low	120 Å²	120	142.4 Å²	142.4	84%	0.839	80%	0.795	S	S	*	*			cis	63.9	125.2	35.8	85.6	0	0	0	0	113.9
186	S	31.6	Very low	31.5	Very low	106 Å²	106	144.1 Å²	144.1	74%	0.741	80%	0.797	S	S	*	*			cis	-167.7	167.1	-7.4	58.1	0	0	0	0	109.4
187	L	32.7	Very low	31.5	Very low	177 Å²	177	144.6 Å²	144.6	93%	0.927	80%	0.796	S	S	*	*			trans	-178.7	170	133.2	-100.5	165.3	0	0	0	111.8
188	S	28.2	Very low	31.3	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	80%	0.799	S	S	*	*			trans	-142.5	145.4	-169.1	176.8	0	0	0	0	112.2
189	K	33.8	Very low	31.2	Very low	212 Å²	212	140.5 Å²	140.5	92%	0.922	79%	0.794	S	S	*	*			trans	-144.4	136.1	159.6	-104.1	173.9	-179.8	176.4	0	109.5
190	R	26.2	Very low	30.9	Very low	217 Å²	217	139.8 Å²	139.8	82%	0.819	79%	0.792	S	S	*	*			trans	-90.8	147.8	178.9	-57.6	174.9	-176.9	167.7	-0.4	110.3
191	F	29.5	Very low	30.5	Very low	219 Å²	219	136.7 Å²	136.7	96%	0.961	79%	0.791	S	S	*	*			trans	-139.6	167.5	134.6	-93.7	-72	0	0	0	108.9
192	V	32.5	Very low	30.3	Very low	114 Å²	114	137 Å²	137	69%	0.691	79%	0.786	S	S	*	*			trans	-122.9	136.9	-147.2	168.1	0	0	0	0	113.2
193	M	28.9	Very low	29.9	Very low	148 Å²	148	139.4 Å²	139.4	73%	0.729	78%	0.778	S	S	*	*			trans	34.9	121.1	158.3	-66.1	168.2	135.3	0	0	119.8	D195	M193-D195 WeakPolarHBondContact CE-OD2 3.47Å; M193-D195 WeakPolarHBondContact CG-OD2 3.35Å
194	K	30.3	Very low	29.7	Very low	214 Å²	214	141.9 Å²	141.9	93%	0.93	77%	0.771	S	S	*	*				-141	104.5	116.3	-143.6	173.8	-172	178.4	0	110.1
195	D	31.4	Very low	29.3	Very low	104 Å²	104	147.8 Å²	147.8	56%	0.556	77%	0.773	S	S	*	*			trans	-69.8	162.2	172.5	-49.9	-81.7	0	0	0	109.2	M193	M193-D195 WeakPolarHBondContact CE-OD2 3.47Å; M193-D195 WeakPolarHBondContact CG-OD2 3.35Å
196	D	31.4	Very low	29.1	Very low	161 Å²	161	150.1 Å²	150.1	86%	0.861	77%	0.771	S	S	*	*			cis	-121.4	156.4	26.2	-117.3	-48.7	0	0	0	116.1
197	S	29.9	Very low	28.9	Very low	89 Å²	89	149.6 Å²	149.6	62%	0.622	77%	0.767	S	S	*	*			trans	-97.1	134.7	-162	67.2	0	0	0	0	116.2	S199	S197-S199 PolarHBondContact O-N 3.46Å
198	V	29.4	Very low	28.7	Very low	145 Å²	145	147.1 Å²	147.1	88%	0.879	76%	0.759	S	S	*	*			trans	-29.9	111.3	145.5	177.3	0	0	0	0	112.5
199	S	27.6	Very low	28.6	Very low	107 Å²	107	148 Å²	148	75%	0.748	76%	0.764	S	S	*	*			trans	-162.6	134	165.9	-91.8	0	0	0	0	112.5	S197	S197-S199 PolarHBondContact O-N 3.46Å
200	S	27.4	Very low	28.3	Very low	92 Å²	92	144.6 Å²	144.6	64%	0.643	76%	0.756	S	S	*	*			cis	-151	129.7	-12.4	51.7	0	0	0	0	109.9	I202	S200-I202 PolarHBondContact O-N 3.47Å; S200-I202 VanDerWaalsContact O-N 3.15Å
201	S	26.2	Very low	28.5	Very low	117 Å²	117	143 Å²	143	82%	0.818	76%	0.758	S	S	*	*			trans	-76.4	98.4	170.8	42.6	0	0	0	0	109.1	M203	S201-M203 PolarHBondContact O-N 3.13Å
202	I	27.7	Very low	28.5	Very low	139 Å²	139	137.6 Å²	137.6	71%	0.713	75%	0.747	S	S	*	*			trans	-71.6	79.2	170.7	-56.8	-178.4	0	0	0	108.5	S200 R204	S200-I202 PolarHBondContact O-N 3.47Å; S200-I202 VanDerWaalsContact O-N 3.15Å; I202-R204 HydrophobicContact CG2-CG 4.31Å; I202-R204 PolarHBondContact O-N 3.49Å
203	M	26.8	Very low	28.5	Very low	127 Å²	127	139 Å²	139	63%	0.626	76%	0.756	S	S	*	*			trans	-69.6	92.7	175.1	-168.6	139.6	103	0	0	108.5	S201 Y205	S201-M203 PolarHBondContact O-N 3.13Å; M203-Y205 HydrophobicContact CE-CE1 4.1Å; M203-Y205 HydrophobicContact CE-CE2 3.67Å; M203-Y205 VanDerWaalsContact CE-CZ 3.4Å; M203-Y205 VanDerWaalsContact CE-OH 3.22Å; M203-Y205 WeakPolarHBondContact CE-OH 3.3Å; M203-Y205 HydrophobicContact CG-CD2 4.25Å; M203-Y205 HydrophobicContact CG-CE2 4.18Å; M203-Y205 PolarHBondContact O-N 2.74Å
204	R	26.7	Very low	28.5	Very low	206 Å²	206	140.8 Å²	140.8	78%	0.777	76%	0.763	S	S	*	*			trans	-71	83.5	170.2	-66.9	-168.6	-174.3	-155.8	1.9	109.2	I202 H206	I202-R204 HydrophobicContact CG2-CG 4.31Å; I202-R204 PolarHBondContact O-N 3.49Å; R204-H206 PolarHBondContact O-N 3.25Å
205	Y	25	Very low	28.6	Very low	189 Å²	189	140.7 Å²	140.7	74%	0.741	76%	0.762	S	S	*	*			trans	-52.5	108.5	156.2	-75	-81.7	0	0	0	108.1	M203 S207	M203-Y205 HydrophobicContact CE-CE1 4.1Å; M203-Y205 HydrophobicContact CE-CE2 3.67Å; M203-Y205 VanDerWaalsContact CE-CZ 3.4Å; M203-Y205 VanDerWaalsContact CE-OH 3.22Å; M203-Y205 WeakPolarHBondContact CE-OH 3.3Å; M203-Y205 HydrophobicContact CG-CD2 4.25Å; M203-Y205 HydrophobicContact CG-CE2 4.18Å; M203-Y205 PolarHBondContact O-N 2.74Å; Y205-S207 VanDerWaalsContact C-N 3.34Å; Y205-S207 PolarHBondContact O-N 3.19Å
206	H	28.2	Very low	28.5	Very low	170 Å²	170	142.4 Å²	142.4	79%	0.787	77%	0.77	S	S	*	*			trans	-78.2	96.5	154	-80.6	-89.4	0	0	0	105.6	R204 V208	R204-H206 PolarHBondContact O-N 3.25Å; H206-V208 PolarHBondContact O-N 3.03Å; H206-V208 VanDerWaalsContact O-N 3.16Å
207	S	27.1	Very low	28.5	Very low	95 Å²	95	143.1 Å²	143.1	66%	0.664	77%	0.768	S	S	*	*			trans	-59.8	116.4	177.2	52.6	0	0	0	0	109.5	Y205 C209	Y205-S207 VanDerWaalsContact C-N 3.34Å; Y205-S207 PolarHBondContact O-N 3.19Å; S207-C209 PolarHBondContact O-N 2.84Å
208	V	28.4	Very low	28.6	Very low	125 Å²	125	144.7 Å²	144.7	76%	0.758	77%	0.774	S	S	*	*			trans	-66.9	115.6	163.2	178.2	0	0	0	0	106.5	H206 N210	H206-V208 PolarHBondContact O-N 3.03Å; H206-V208 VanDerWaalsContact O-N 3.16Å; V208-N210 VanDerWaalsContact C-N 3.34Å; V208-N210 PolarHBondContact O-N 3.1Å
209	C	27.6	Very low	28.5	Very low	119 Å²	119	145.1 Å²	145.1	80%	0.804	77%	0.77	S	S	*	*			trans	-79.2	81.9	-178.8	-64.8	0	0	0	0	110.9	S207	S207-C209 PolarHBondContact O-N 2.84Å
210	N	26.9	Very low	28.8	Very low	140 Å²	140	145.9 Å²	145.9	75%	0.749	77%	0.772	S	S	*	*			trans	-99.9	114.7	160.5	-81.8	-0.4	0	0	0	108.9	V208	V208-N210 VanDerWaalsContact C-N 3.34Å; V208-N210 PolarHBondContact O-N 3.1Å
211	E	29.6	Very low	28.9	Very low	183 Å²	183	150.8 Å²	150.8	86%	0.855	78%	0.782	S	S	*	*			trans	165.5	92.4	157	-96.6	170.8	-160.8	0	0	106.3
212	S	29.2	Very low	29.2	Very low	106 Å²	106	152.5 Å²	152.5	74%	0.741	78%	0.78	S	S	*	*				68.3	89.5	87.3	73.1	0	0	0	0	114.2
213	T	32.5	Very low	29.5	Very low	144 Å²	144	153.1 Å²	153.1	88%	0.883	78%	0.78	S	S	*	*			trans	-131.2	134.5	149.7	34	0	0	0	0	108.5
214	Q	29.9	Very low	29.6	Very low	184 Å²	184	156.4 Å²	156.4	86%	0.86	79%	0.794	S	S	*	*			trans	-70.9	137.7	-171	-64.6	159.6	-48.2	0	0	111.6
215	K	32.8	Very low	29.8	Very low	212 Å²	212	157.5 Å²	157.5	92%	0.922	80%	0.798	S	S	*	*			trans	-146.8	110.1	142	-116.7	172.9	-175.1	-177.7	0	110.2
216	I	27.7	Very low	30	Very low	140 Å²	140	153.5 Å²	153.5	72%	0.718	80%	0.798	S	S	*	*			trans	-67	136.7	176	-62.7	160.2	0	0	0	108.5
217	H	32.7	Very low	29.9	Very low	177 Å²	177	150.3 Å²	150.3	82%	0.819	80%	0.801	S	S	*	*			trans	-168.2	104.8	134.4	-94.8	-54.8	0	0	0	112
218	T	32.3	Very low	30.1	Very low	121 Å²	121	152.7 Å²	152.7	74%	0.742	81%	0.805	S	S	*	*			trans	45	115.8	141.5	-31.3	0	0	0	0	120.3
219	I	26.2	Very low	29.9	Very low	155 Å²	155	156 Å²	156	80%	0.795	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-102.6	136.8	170.4	-63.5	164.3	0	0	0	110.1
220	P	33.8	Very low	30.2	Very low	122 Å²	122	156.5 Å²	156.5	79%	0.792	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-87.7	137.9	154.4	-6	25.4	0	0	0	111.2
221	K	30.2	Very low	30.2	Very low	196 Å²	196	156.9 Å²	156.9	85%	0.852	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-77.1	164.3	171.2	-65.7	180	174.5	-175.8	0	111.6
222	I	32.4	Very low	30.1	Very low	152 Å²	152	152.4 Å²	152.4	78%	0.779	80%	0.802	S	S	*	*			trans	149.2	135.8	154.9	-82.9	154.9	0	0	0	107.1
223	E	33.8	Very low	30.1	Very low	153 Å²	153	154.9 Å²	154.9	72%	0.715	80%	0.801	S	S	*	*			cis	-154.8	162.2	-17.4	-108.4	169.7	177	0	0	107.3
224	E	28.4	Very low	30.1	Very low	195 Å²	195	155.3 Å²	155.3	91%	0.911	79%	0.793	S	S	*	*			trans	-83.1	130.3	171.4	-68.6	177.6	117	0	0	110.6
225	W	30.6	Very low	30.1	Very low	229 Å²	229	154 Å²	154	87%	0.867	79%	0.792	S	S	*	*			trans	-126.1	129	165.3	-83.8	64	0	0	0	109.3
226	S	30.1	Very low	29.9	Very low	106 Å²	106	151.6 Å²	151.6	74%	0.741	78%	0.784	S	S	*	*			trans	-82.7	164.8	-167.9	51.7	0	0	0	0	113.6
227	A	26	Very low	29.8	Very low	103 Å²	103	155.6 Å²	155.6	85%	0.851	79%	0.791	S	S	*	*			trans	-60.1	143.9	170.5	0	0	0	0	0	111.5
228	I	30.2	Very low	29.6	Very low	144 Å²	144	153.4 Å²	153.4	74%	0.738	79%	0.791	S	S	*	*			trans	-126.3	122.3	168.2	-68.5	177.1	0	0	0	106.8	V230	I228-V230 HydrophobicContact CG2-CG2 3.83Å
229	E	25.9	Very low	29.4	Very low	196 Å²	196	158 Å²	158	92%	0.916	80%	0.795	S	S	*	*			trans	-104.5	118.4	175.9	-176.2	170.5	-115.9	0	0	107.2
230	V	32.2	Very low	29.3	Very low	128 Å²	128	162.3 Å²	162.3	78%	0.776	80%	0.801	S	S	*	*			trans	-137.2	126.1	174.4	176.2	0	0	0	0	108	I228	I228-V230 HydrophobicContact CG2-CG2 3.83Å
231	D	26.7	Very low	29.1	Very low	148 Å²	148	165.2 Å²	165.2	79%	0.791	80%	0.801	S	S	*	*			trans	-97.6	177.7	-173.6	-155.6	-11.2	0	0	0	111.4
232	S	28.6	Very low	28.9	Very low	89 Å²	89	161 Å²	161	62%	0.622	80%	0.796	S	S	*	*			trans	83.6	122.7	152.2	80	0	0	0	0	120.9
233	H	29.7	Very low	28.7	Very low	158 Å²	158	159.1 Å²	159.1	73%	0.731	79%	0.792	S	S	*	*			trans	65.7	128.8	139.3	-66.6	-55.9	0	0	0	124.3
234	H	31.3	Very low	28.3	Very low	153 Å²	153	161 Å²	161	71%	0.708	80%	0.798	S	S	*	*			trans	53.7	108.5	143.6	-55.7	-46.1	0	0	0	119.8
235	N	31.3	Very low	28.4	Very low	157 Å²	157	157.8 Å²	157.8	84%	0.84	80%	0.797	S	S	*	*				-170.8	162.7	83.8	-96.2	-58.4	0	0	0	113.1
236	E	28.5	Very low	28.2	Very low	162 Å²	162	151 Å²	151	76%	0.757	79%	0.79	S	S	*	*			trans	-74.6	145	171	-55	177.8	125.4	0	0	110.9
237	Y	26	Very low	28.3	Very low	223 Å²	223	152.3 Å²	152.3	88%	0.875	80%	0.795	S	S	*	*				175.6	143.1	120.7	-102.5	-69	0	0	0	113	R239	Y237-R239 PolarHBondContact O-N 2.91Å
238	T	26.7	Very low	28.5	Very low	132 Å²	132	156.1 Å²	156.1	81%	0.81	80%	0.796	S	S	*	*			trans	-69	121.8	-176.2	-51.4	0	0	0	0	113.9
239	R	28	Very low	28.6	Very low	218 Å²	218	157.3 Å²	157.3	82%	0.823	80%	0.803	S	S	*	*			trans	-141.4	136.6	155	-99.4	-176.8	-171.3	-154.9	0.3	113.4	Y237 F241	Y237-R239 PolarHBondContact O-N 2.91Å; R239-F241 HydrophobicContact CB-CE2 4.42Å
240	R	25.5	Very low	28.7	Very low	244 Å²	244	152.8 Å²	152.8	92%	0.921	79%	0.789	S	S	*	*			trans	-78	127.8	171.9	-66.5	174.2	174.4	171.1	-2.7	109.6
241	F	29.5	Very low	28.5	Very low	183 Å²	183	157.5 Å²	157.5	80%	0.803	79%	0.793	S	S	*	*			trans	-128.3	133.7	158.5	-83.2	-80.2	0	0	0	111	R239	R239-F241 HydrophobicContact CB-CE2 4.42Å
242	S	24.9	Very low	28.6	Very low	107 Å²	107	159 Å²	159	75%	0.748	80%	0.795	S	S	*	*			trans	-96.5	-166.1	160.5	63.8	0	0	0	0	108.6
243	V	27.9	Very low	28.6	Very low	114 Å²	114	160.8 Å²	160.8	69%	0.691	81%	0.806	S	S	*	*			trans	94.1	99.7	175.5	-171.9	0	0	0	0	115.9
244	K	26.3	Very low	28.5	Very low	193 Å²	193	159.2 Å²	159.2	84%	0.839	81%	0.807	S	S	*	*			trans	34.5	109.1	133.6	-47.2	169.7	-165.4	164.5	0	118.3
245	S	30.1	Very low	28.2	Very low	127 Å²	127	162.5 Å²	162.5	89%	0.888	81%	0.814	S	S	*	*				-163.5	130.9	117.7	45.2	0	0	0	0	110.8
246	A	26.7	Very low	27.9	Very low	86 Å²	86	162.1 Å²	162.1	71%	0.711	81%	0.81	S	S	*	*			trans	-121.1	131.1	159.1	0	0	0	0	0	105.4
247	P	32.6	Very low	27.7	Very low	133 Å²	133	164.5 Å²	164.5	86%	0.864	81%	0.812	S	S	*	*			trans	-65.2	139.1	-175.9	26	-33.6	0	0	0	111	D249	P247-D249 PolarHBondContact O-N 3.37Å
248	E	29.8	Very low	27.9	Very low	183 Å²	183	159.5 Å²	159.5	86%	0.855	81%	0.807	S	S	*	*			trans	-83.1	112.5	178.5	-67.7	-176.2	99.5	0	0	110.7
249	D	31.9	Very low	27.9	Very low	169 Å²	169	162.3 Å²	162.3	90%	0.904	81%	0.808	S	S	*	*			trans	-123.2	78	157.7	-149.2	-20.1	0	0	0	110.3	P247	P247-D249 PolarHBondContact O-N 3.37Å
250	V	29.6	Very low	27.8	Very low	102 Å²	102	164.3 Å²	164.3	62%	0.618	82%	0.815	S	S	*	*			trans	-106.5	99.6	-172.7	-179.2	0	0	0	0	110.4
251	R	26.8	Very low	27.9	Very low	226 Å²	226	157.1 Å²	157.1	85%	0.853	80%	0.802	S	S	*	*			trans	-177.4	111.1	142.9	-87.5	131.2	-141.6	-130.8	10	110.7
252	H	28.4	Very low	27.8	Very low	179 Å²	179	153 Å²	153	83%	0.829	80%	0.802	S	S	*	*			trans	172	25.8	138.7	-96.4	72.4	0	0	0	115.2	V254	H252-V254 PolarHBondContact O-N 3.27Å; H252-V254 VanDerWaalsContact O-N 3.16Å
253	C	28.1	Very low	27.9	Very low	128 Å²	128	154.3 Å²	154.3	87%	0.865	81%	0.806	S	S	*	*			trans	-77.8	100	173.5	-76.6	0	0	0	0	112.8	R255	C253-R255 PolarHBondContact O-N 3.12Å; C253-R255 VanDerWaalsContact O-N 3.12Å
254	V	28.1	Very low	27.9	Very low	125 Å²	125	158.1 Å²	158.1	76%	0.758	81%	0.813	S	S	*	*			trans	-61.3	110	176.2	179.6	0	0	0	0	111.1	H252 I256	H252-V254 PolarHBondContact O-N 3.27Å; H252-V254 VanDerWaalsContact O-N 3.16Å; V254-I256 HydrophobicContact CG1-CG1 4.19Å; V254-I256 PolarHBondContact O-N 3.22Å
255	R	24.9	Very low	28	Very low	222 Å²	222	157.9 Å²	157.9	84%	0.838	81%	0.812	S	S	*	*			trans	-73.2	77.4	-179.1	-76.5	-179.9	166.4	171	-2.9	113	C253 R257	C253-R255 PolarHBondContact O-N 3.12Å; C253-R255 VanDerWaalsContact O-N 3.12Å; R255-R257 PolarHBondContact O-N 3.27Å
256	I	26.2	Very low	27.7	Very low	149 Å²	149	162.6 Å²	162.6	76%	0.764	81%	0.811	S	S	*	*			trans	-72	90.1	166.1	-54.7	-178.2	0	0	0	109.2	V254 P258	V254-I256 HydrophobicContact CG1-CG1 4.19Å; V254-I256 PolarHBondContact O-N 3.22Å; I256-P258 VanDerWaalsContact O-CD 3.31Å; I256-P258 WeakPolarHBondContact O-CD 3.13Å
257	R	24.4	Very low	27.7	Very low	212 Å²	212	167.2 Å²	167.2	80%	0.8	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-72.1	118	169.8	-78.3	179.2	166.7	173.8	-4.7	110.3	R255 K259	R255-R257 PolarHBondContact O-N 3.27Å; R257-K259 PolarHBondContact O-N 3.1Å
258	P	28.6	Very low	27.4	Very low	118 Å²	118	170.2 Å²	170.2	77%	0.766	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.5	123.2	167.5	-13.3	30	0	0	0	109.5	I256 R260	I256-P258 VanDerWaalsContact O-CD 3.31Å; I256-P258 WeakPolarHBondContact O-CD 3.13Å; P258-R260 PolarHBondContact O-N 3.25Å
259	K	28.1	Very low	27.2	Very low	191 Å²	191	171 Å²	171	83%	0.83	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-66.1	120.2	177.1	-74.4	-174.3	175.4	-177.5	0	110.6	R257 S261	R257-K259 PolarHBondContact O-N 3.1Å; K259-S261 PolarHBondContact O-N 3.4Å; K259-S261 VanDerWaalsContact O-N 3.07Å
260	R	26	Very low	26.8	Very low	260 Å²	260	173.5 Å²	173.5	98%	0.981	81%	0.812	S	S	*	*			trans	-74.7	84.3	167.2	-78.9	-177.6	168.7	177.8	-4	109.9	P258	P258-R260 PolarHBondContact O-N 3.25Å
261	S	26.7	Very low	26.8	Very low	92 Å²	92	176 Å²	176	64%	0.643	82%	0.821	S	S	*	*			trans	-157.1	70.6	178	60.4	0	0	0	0	113.4	K259	K259-S261 PolarHBondContact O-N 3.4Å; K259-S261 VanDerWaalsContact O-N 3.07Å
262	A	28.5	Very low	26.8	Very low	96 Å²	96	170.5 Å²	170.5	79%	0.793	82%	0.815	S	S	*	*			trans	-156	27.3	172.7	0	0	0	0	0	113.7	K264	A262-K264 PolarHBondContact O-N 3.49Å
263	T	26.6	Very low	26.8	Very low	136 Å²	136	172 Å²	172	83%	0.834	82%	0.819	S	S	*	*			trans	-82.4	70	-176.3	34.3	0	0	0	0	113
264	K	28.3	Very low	26.8	Very low	194 Å²	194	170.7 Å²	170.7	84%	0.843	81%	0.811	S	S	*	*	S	Bend	trans	-179	148.7	153.8	-102.2	148.8	-173.1	176.8	0	111.9	A262	A262-K264 PolarHBondContact O-N 3.49Å
265	K	27.1	Very low	26.6	Very low	187 Å²	187	168.7 Å²	168.7	81%	0.813	80%	0.803	S	S	*	*			trans	72	126.7	164.5	-69.1	179	178	178.8	0	118.4
266	W	24.5	Very low	26.8	Very low	227 Å²	227	166.6 Å²	166.6	86%	0.86	81%	0.807	S	S	*	*			trans	77.8	134.1	167.1	-48.9	5.5	0	0	0	114
267	F	27.3	Very low	26.9	Very low	183 Å²	183	165.4 Å²	165.4	80%	0.803	80%	0.802	S	S	*	*			cis	-117.1	144.3	18.2	-72	-104.7	0	0	0	114
268	K	25	Very low	27.1	Very low	195 Å²	195	163.8 Å²	163.8	85%	0.848	81%	0.808	S	S	*	*			trans	-93.6	98.6	164.8	-173.7	171	-173.6	169.2	0	108.5	R270	K268-R270 PolarHBondContact O-N 2.89Å
269	F	25.5	Very low	27.1	Very low	200 Å²	200	167 Å²	167	88%	0.877	81%	0.81	S	S	*	*			trans	-67	98.9	173.8	-105.7	-85.8	0	0	0	109.5
270	R	24.8	Very low	27	Very low	221 Å²	221	161.9 Å²	161.9	83%	0.834	80%	0.799	S	S	*	*			trans	-69.3	125.8	164	-77.7	177.9	166.5	160	-5.4	107.9	K268	K268-R270 PolarHBondContact O-N 2.89Å
271	L	28.7	Very low	27.1	Very low	154 Å²	154	157.8 Å²	157.8	81%	0.806	79%	0.791	S	S	*	*			trans	-53.9	144.8	158.4	-75	164.7	0	0	0	109	K273	L271-K273 PolarHBondContact O-N 2.76Å
272	P	27.8	Very low	27.3	Very low	111 Å²	111	161.9 Å²	161.9	72%	0.721	80%	0.803	S	S	*	*			trans	-64.4	96.4	168.9	-17.8	31.7	0	0	0	110	S274	P272-S274 PolarHBondContact O-N 2.81Å
273	K	27.2	Very low	27.2	Very low	212 Å²	212	159.9 Å²	159.9	92%	0.922	79%	0.792	S	S	*	*			trans	-73.5	67	156.6	-76	-163.5	172.1	-165.1	0	108.3	L271	L271-K273 PolarHBondContact O-N 2.76Å
274	S	27.8	Very low	27.2	Very low	99 Å²	99	161 Å²	161	69%	0.692	79%	0.793	S	S	*	*			trans	-92.7	95.2	173.6	50.7	0	0	0	0	108.8	P272 L276	P272-S274 PolarHBondContact O-N 2.81Å; S274-L276 PolarHBondContact O-N 3.24Å
275	S	25.3	Very low	27.4	Very low	84 Å²	84	160.6 Å²	160.6	59%	0.587	79%	0.791	S	S	*	*			trans	-54.1	122.4	176.6	49.2	0	0	0	0	113.1	N277	S275-N277 WeakPolarHBondContact CB-OD1 3.48Å
276	L	28.8	Very low	27.4	Very low	177 Å²	177	159.1 Å²	159.1	93%	0.927	79%	0.791	S	S	*	*			trans	-97	113.5	132.7	-77.7	172.1	0	0	0	106	S274 L278	S274-L276 PolarHBondContact O-N 3.24Å; L276-L278 PolarHBondContact O-N 2.98Å
277	N	27.5	Very low	27.5	Very low	124 Å²	124	152.4 Å²	152.4	66%	0.663	78%	0.779	S	S	*	*			trans	-79.5	115	-179.8	-67.6	-37.7	0	0	0	109	S275 K279	S275-N277 WeakPolarHBondContact CB-OD1 3.48Å; N277-K279 HydrophobicContact CB-CG 4.45Å; N277-K279 PolarHBondContact O-N 3.37Å
278	L	28.2	Very low	27.5	Very low	178 Å²	178	150 Å²	150	93%	0.932	78%	0.779	S	S	*	*			trans	-66.3	94.7	146.3	-88.9	86.5	0	0	0	106.6	L276 S280	L276-L278 PolarHBondContact O-N 2.98Å; L278-S280 PolarHBondContact O-N 2.8Å
279	K	28.8	Very low	27.6	Very low	186 Å²	186	143.5 Å²	143.5	81%	0.809	76%	0.762	S	S	*	*			trans	-80.2	99.2	166.3	-104.7	-168.5	170.1	-168.5	0	108.3	N277	N277-K279 HydrophobicContact CB-CG 4.45Å; N277-K279 PolarHBondContact O-N 3.37Å
280	S	26.1	Very low	27.8	Very low	84 Å²	84	141.6 Å²	141.6	59%	0.587	76%	0.756	S	S	*	*			trans	-59.4	170.1	146.1	51.6	0	0	0	0	110.1	L278	L278-S280 PolarHBondContact O-N 2.8Å
281	H	27.8	Very low	27.9	Very low	174 Å²	174	139.2 Å²	139.2	81%	0.806	76%	0.755	S	S	*	*			trans	75.4	75.4	-174.3	-47.7	-79.4	0	0	0	115.7
282	I	31.7	Very low	27.9	Very low	178 Å²	178	139.4 Å²	139.4	91%	0.913	75%	0.751	S	S	*	*				-104.8	131	111	-63.5	178.1	0	0	0	105.9
283	G	26	Very low	27.8	Very low	54 Å²	54	140.4 Å²	140.4	56%	0.557	75%	0.749	S	S	*	*			trans	-129.1	-179.7	173.7	0	0	0	0	0	110.2
284	N	27.8	Very low	27.8	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	74%	0.74	S	S	*	*			trans	71.6	72.5	173.6	-52.8	-8.7	0	0	0	116.2
285	K	32.3	Very low	27.6	Very low	186 Å²	186	141.1 Å²	141.1	81%	0.809	74%	0.743	S	S	*	*				-176.7	132.6	107.2	-91.6	159.9	-177.4	-173.4	0	108
286	L	25.9	Very low	27.6	Very low	157 Å²	157	141.3 Å²	141.3	82%	0.822	74%	0.744	S	S	*	*				51.2	120.3	78.5	-72.7	142.5	0	0	0	111.6
287	S	26.3	Very low	27.4	Very low	86 Å²	86	142.2 Å²	142.2	60%	0.601	74%	0.74	S	S	*	*			cis	-172.5	171.6	-8.9	47.3	0	0	0	0	107.9
288	T	27.6	Very low	27.3	Very low	131 Å²	131	141.4 Å²	141.4	80%	0.804	74%	0.744	S	S	*	*			trans	57.7	139.4	149.2	45.9	0	0	0	0	119.2
289	A	27.6	Very low	27.2	Very low	60 Å²	60	139 Å²	139	50%	0.496	74%	0.736	S	S	.	*			cis	-166.9	-169.8	-10.3	0	0	0	0	0	108.4
290	E	30.1	Very low	27	Very low	160 Å²	160	138.5 Å²	138.5	75%	0.748	74%	0.735	S	S	*	*			trans	63.4	141.8	165.4	-76.2	97.7	-113	0	0	116.3
291	E	26.8	Very low	27	Very low	171 Å²	171	140.6 Å²	140.6	80%	0.799	74%	0.737	S	S	*	*				66.4	131.5	57.6	-76.2	167.4	-177.6	0	0	110.6
292	E	28.5	Very low	27	Very low	158 Å²	158	139.2 Å²	139.2	74%	0.738	73%	0.731	S	S	*	*			cis	-149.8	151.5	22.1	-117.2	179.7	152.8	0	0	110.5
293	I	26.4	Very low	26.9	Very low	131 Å²	131	136.5 Å²	136.5	67%	0.672	72%	0.722	S	S	*	*				59.1	120	98.8	-71.4	-177.6	0	0	0	116.7
294	F	25.8	Very low	26.9	Very low	169 Å²	169	139.2 Å²	139.2	74%	0.741	73%	0.733	S	S	*	*			trans	66	120.8	150.3	-85	-123.7	0	0	0	122.8
295	E	24.7	Very low	26.9	Very low	158 Å²	158	136.7 Å²	136.7	74%	0.738	73%	0.728	S	S	*	*				67.3	135.3	111.7	-156.3	170.1	-117.1	0	0	122.6
296	S	24.9	Very low	26.8	Very low	87 Å²	87	136.7 Å²	136.7	61%	0.608	73%	0.731	S	S	*	*			trans	74.7	114.7	152.1	65.5	0	0	0	0	123.3
297	K	24.7	Very low	26.9	Very low	196 Å²	196	132.9 Å²	132.9	85%	0.852	73%	0.729	S	S	*	*				70.4	165	127.2	-64.7	173.9	-178.5	169.9	0	120.1
298	S	25.2	Very low	27	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	74%	0.743	S	S	*	*			trans	72.7	119.2	-179.5	-25.6	0	0	0	0	113
299	V	25.4	Very low	27	Very low	127 Å²	127	138.9 Å²	138.9	77%	0.77	75%	0.745	S	S	*	*			cis	75.7	142.8	38.9	-168.4	0	0	0	0	112.3
300	F	24.4	Very low	27	Very low	177 Å²	177	140.6 Å²	140.6	78%	0.776	75%	0.753	S	S	*	*			trans	79.4	136	-170.4	-70.7	-99.1	0	0	0	116
301	M	27.5	Very low	26.8	Very low	128 Å²	128	140.1 Å²	140.1	63%	0.631	75%	0.754	S	S	*	*			cis	-163.9	174.6	-26	-129	-168.6	162.2	0	0	111.4
302	E	27	Very low	26.8	Very low	145 Å²	145	140.3 Å²	140.3	68%	0.678	76%	0.76	S	S	*	*			trans	22	136.2	147.9	-64.2	177.7	161.1	0	0	120.4
303	T	29.9	Very low	26.8	Very low	120 Å²	120	135.8 Å²	135.8	74%	0.736	76%	0.756	S	S	*	*				-165.8	149.2	66.5	27.3	0	0	0	0	112.6
304	S	26.6	Very low	27	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	76%	0.764	S	S	*	*			trans	30	144.5	149.4	64.1	0	0	0	0	121.4
305	S	27.7	Very low	27.1	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	76%	0.763	S	S	*	*			cis	-166.1	172.1	-3.2	51.8	0	0	0	0	105.4
306	Q	30.8	Very low	27.3	Very low	187 Å²	187	138.1 Å²	138.1	87%	0.874	76%	0.755	S	S	*	*			cis	-148.2	164.9	31.9	-61.5	170.9	-13.9	0	0	107.3
307	G	27.4	Very low	27.5	Very low	77 Å²	77	139.9 Å²	139.9	79%	0.794	76%	0.758	S	S	*	*			cis	130.6	77.6	13.8	0	0	0	0	0	109.7
308	K	28.6	Very low	27.6	Very low	206 Å²	206	137.4 Å²	137.4	90%	0.896	75%	0.753	S	S	*	*			trans	-119.1	77.8	-180	-100	-168.2	177	-179.3	0	111.9
309	T	27.2	Very low	27.8	Very low	136 Å²	136	135.6 Å²	135.6	83%	0.834	75%	0.752	S	S	*	*			trans	-162.2	142.8	155.5	10.5	0	0	0	0	112.4
310	S	26.5	Very low	27.9	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	75%	0.749	S	S	*	*			trans	70.1	123.3	150.8	69.7	0	0	0	0	122.1
311	I	26.9	Very low	28.2	Very low	150 Å²	150	133.8 Å²	133.8	77%	0.769	75%	0.754	S	S	*	*				88.4	121.7	129.9	-69.1	166.7	0	0	0	120.8
312	L	26.5	Very low	28.4	Very low	174 Å²	174	131 Å²	131	91%	0.911	76%	0.759	S	S	*	*			trans	71.5	146	157.5	-109.6	69.7	0	0	0	121.7
313	G	28.8	Very low	28.7	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	76%	0.76	S	S	*	*			trans	95.8	113.6	176.7	0	0	0	0	0	112.6
314	K	29.6	Very low	28.7	Very low	197 Å²	197	131.4 Å²	131.4	86%	0.857	76%	0.764	S	S	*	*				57.5	126	54.3	-57.2	-175.2	180	177.7	0	111.9
315	R	27.7	Very low	29	Very low	190 Å²	190	129.2 Å²	129.2	72%	0.717	76%	0.76	S	S	*	*			cis	-163.8	148.6	6.7	-125.7	-173.9	170.5	176.5	-13.7	113.3
316	E	29	Very low	29.1	Very low	120 Å²	120	130.7 Å²	130.7	56%	0.561	76%	0.76	S	S	*	*			trans	39.3	130.5	131.7	-74.1	160	-141.1	0	0	122.3
317	N	29	Very low	29.1	Very low	125 Å²	125	130.1 Å²	130.1	67%	0.668	76%	0.762	S	S	*	*			trans	74.3	158.4	135	-59.4	-7.6	0	0	0	119.9
318	N	28.1	Very low	29.1	Very low	143 Å²	143	135.3 Å²	135.3	77%	0.765	76%	0.763	S	S	*	*			cis	-165.2	155.9	-25.9	-101.1	-17.4	0	0	0	110.8
319	G	29.4	Very low	29.5	Very low	69 Å²	69	130.8 Å²	130.8	71%	0.711	76%	0.755	S	S	*	*			trans	74.2	176	157.5	0	0	0	0	0	117.7
320	S	27.6	Very low	29.8	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	75%	0.748	S	S	*	*			cis	176.6	136	-24.7	43.3	0	0	0	0	109.5
321	D	30.5	Very low	30.2	Very low	165 Å²	165	132.3 Å²	132.3	88%	0.882	75%	0.754	S	S	*	*			trans	62.9	152.8	157.2	-50	-33.3	0	0	0	120.5
322	G	32.2	Very low	30.6	Very low	71 Å²	71	130 Å²	130	73%	0.732	75%	0.749	S	S	*	*			trans	129.6	61.4	-177.1	0	0	0	0	0	113.5
323	V	31.8	Very low	30.6	Very low	118 Å²	118	129.2 Å²	129.2	72%	0.715	75%	0.745	S	S	*	*				81.2	131.5	66.8	174.1	0	0	0	0	113.8
324	D	31.3	Very low	30.6	Very low	154 Å²	154	138.3 Å²	138.3	82%	0.824	76%	0.76	S	S	*	*			trans	64.6	141.5	172.6	-63.8	-28	0	0	0	120.5
325	G	33.1	Very low	30.5	Very low	67 Å²	67	135.5 Å²	135.5	69%	0.691	75%	0.748	S	S	*	*			cis	-171.4	154.8	-2.7	0	0	0	0	0	117.4
326	N	28.2	Very low	30.5	Very low	134 Å²	134	135 Å²	135	72%	0.717	76%	0.759	S	S	*	*			trans	-13	141.5	167.9	-54.7	-49.6	0	0	0	121
327	L	31.8	Very low	30.5	Very low	175 Å²	175	134.4 Å²	134.4	92%	0.916	77%	0.768	S	S	*	*				-175	149.2	106.8	-94.5	158.8	0	0	0	114
328	F	26.5	Very low	30.4	Very low	187 Å²	187	135 Å²	135	82%	0.82	78%	0.776	S	S	*	*			trans	-105.7	-169.9	-176.1	-80.8	-100.8	0	0	0	111.1
329	P	36.7	Very low	30.3	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	78%	0.777	S	S	*	*				-128.3	-139.4	-51.8	37.5	-17.5	0	0	0	110.3
330	P	35	Very low	30.3	Very low	107 Å²	107	140.3 Å²	140.3	70%	0.695	78%	0.784	S	S	*	*				-120	171.1	-55.3	30.3	-11.6	0	0	0	115.5
331	I	33.8	Very low	30.4	Very low	157 Å²	157	143.3 Å²	143.3	81%	0.805	79%	0.791	S	S	*	*			trans	25.4	133.5	139.4	-61.6	171.3	0	0	0	119.1
332	P	34.8	Very low	30.3	Very low	103 Å²	103	142.4 Å²	142.4	67%	0.669	79%	0.786	S	S	*	*			cis	-144.2	176.8	34.8	28.9	-3.6	0	0	0	119.5
333	N	27.2	Very low	30	Very low	156 Å²	156	148.9 Å²	148.9	83%	0.834	79%	0.794	S	S	*	*			trans	55.3	102.2	148.4	-67.9	-12	0	0	0	121.9
334	R	28.3	Very low	29.8	Very low	254 Å²	254	147.8 Å²	147.8	96%	0.958	79%	0.792	S	S	*	*			trans	-153.4	155.3	132.9	-119.4	169.9	-177	168.5	2.3	112.8
335	K	28.7	Very low	29.7	Very low	139 Å²	139	147.1 Å²	147.1	60%	0.604	79%	0.788	S	S	*	*			trans	-71	145.9	-163.3	-67.7	179.1	173.3	-178.5	0	114.5	S412 E415	K335-S412 PolarHBondContact NZ-O 2.8Å; K335-E415 VanDerWaalsContact CE-OE2 3.3Å; K335-E415 WeakPolarHBondContact CE-OE2 3.31Å; K335-E415 IonicContact NZ-OE2 2.61Å; K335-E415 PolarHBondContact NZ-OE2 3.02Å
336	L	26.7	Very low	29.4	Very low	179 Å²	179	151.3 Å²	151.3	94%	0.937	79%	0.79	S	S	*	*			trans	-56.5	133.2	166.4	-77.4	154.8	0	0	0	111.4
337	S	29	Very low	29.3	Very low	107 Å²	107	153.9 Å²	153.9	75%	0.748	79%	0.789	S	S	*	*			trans	-99	114.5	176.1	51.3	0	0	0	0	111.7	N339	S337-N339 PolarHBondContact O-N 3.33Å
338	T	27.3	Very low	29.2	Very low	137 Å²	137	152.2 Å²	152.2	84%	0.84	78%	0.781	S	S	*	*			trans	-68.9	109.4	176.7	49.5	0	0	0	0	111.5
339	N	27.3	Very low	29.4	Very low	149 Å²	149	150.7 Å²	150.7	80%	0.797	78%	0.776	S	S	*	*			trans	-157.8	66.9	175	-94.4	-38.9	0	0	0	113.4	S337	S337-N339 PolarHBondContact O-N 3.33Å
340	M	28.1	Very low	29.3	Very low	175 Å²	175	151.6 Å²	151.6	86%	0.862	77%	0.77	S	S	*	*			trans	-163	81.6	153.4	-82.8	-136.7	80.9	0	0	110.7
341	I	30	Very low	29.1	Very low	164 Å²	164	149.6 Å²	149.6	84%	0.841	76%	0.759	S	S	*	*			trans	-131.4	128.8	160.3	-62.6	-178.9	0	0	0	107	K343	I341-K343 PolarHBondContact O-N 3.37Å
342	N	29.1	Very low	29	Very low	147 Å²	147	146.8 Å²	146.8	79%	0.786	75%	0.751	S	S	*	*			trans	-65.4	130.7	-175.7	-71.3	-27	0	0	0	111.1	S344	N342-S344 PolarHBondContact O-N 3.02Å
343	K	26.5	Very low	28.9	Very low	207 Å²	207	145.9 Å²	145.9	90%	0.9	74%	0.74	S	S	*	*			trans	-83.2	105.6	174.5	-67.9	174	-177	166.3	0	109.6	I341	I341-K343 PolarHBondContact O-N 3.37Å
344	S	27.7	Very low	29.1	Very low	95 Å²	95	143.2 Å²	143.2	66%	0.664	72%	0.724	S	S	*	*			trans	-69.3	130.8	153.6	46.1	0	0	0	0	108.7	N342 E346	N342-S344 PolarHBondContact O-N 3.02Å; S344-E346 VanDerWaalsContact C-N 3.26Å; S344-E346 PolarHBondContact O-N 3.43Å
345	D	27.1	Very low	29.3	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	70%	0.704	S	S	*	*			trans	-84	69.7	-177.7	-161.1	7.1	0	0	0	110.2	R347	D345-R347 PolarHBondContact O-N 3.11Å
346	E	28.2	Very low	29.4	Very low	155 Å²	155	131.6 Å²	131.6	72%	0.724	69%	0.688	S	S	*	*			trans	-66.8	73.5	-179	-77.2	-160.4	163.9	0	0	113	S344 L348	S344-E346 VanDerWaalsContact C-N 3.26Å; S344-E346 PolarHBondContact O-N 3.43Å; E346-L348 VanDerWaalsContact C-N 3.32Å; E346-L348 PolarHBondContact O-N 2.82Å
347	R	26.6	Very low	29.6	Very low	188 Å²	188	125.3 Å²	125.3	71%	0.709	66%	0.658	S	S	*	*			trans	-66.2	96.2	153.6	-66.5	-175.4	179.3	-172.2	2.1	107.9	D345 H349	D345-R347 PolarHBondContact O-N 3.11Å; R347-H349 PolarHBondContact O-CD2 3.01Å; R347-H349 PolarHBondContact O-N 2.9Å
348	L	28.7	Very low	29.8	Very low	141 Å²	141	123.5 Å²	123.5	74%	0.738	65%	0.65	S	S	*	*			trans	-60.1	79.8	164.8	-75.8	167.6	0	0	0	110.6	E346	E346-L348 VanDerWaalsContact C-N 3.32Å; E346-L348 PolarHBondContact O-N 2.82Å
349	H	30.4	Very low	30.2	Very low	154 Å²	154	120.9 Å²	120.9	71%	0.713	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-65.7	129.2	165.7	-84.6	-105.3	0	0	0	108.1	R347 S351	R347-H349 PolarHBondContact O-CD2 3.01Å; R347-H349 PolarHBondContact O-N 2.9Å; H349-S351 PolarHBondContact O-N 2.7Å
350	H	35.3	Very low	30.4	Very low	130 Å²	130	115.7 Å²	115.7	60%	0.602	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-69.6	120.7	172.3	-65.2	-50.1	0	0	0	108.7
351	S	30.6	Very low	30.6	Very low	65 Å²	65	113.7 Å²	113.7	46%	0.455	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-51.7	135.6	175.4	174.4	0	0	0	0	110.4	H349 L353 I354	H349-S351 PolarHBondContact O-N 2.7Å; S351-L353 PolarHBondContact O-N 2.66Å; S351-I354 PolarHBondContact O-N 3.21Å
352	P	32.7	Very low	30.9	Very low	98 Å²	98	109.1 Å²	109.1	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-52.3	-33.4	-175	-28.8	35.6	0	0	0	113.8	I354 N355 L356	P352-I354 VanDerWaalsContact C-N 3.28Å; P352-I354 PolarHBondContact O-N 2.78Å; P352-I354 VanDerWaalsContact O-N 3.13Å; P352-N355 CarbonylContact O-C 3.57Å; P352-N355 WeakPolarHBondContact O-CA 3.4Å; P352-N355 PolarHBondContact O-N 2.85Å; P352-L356 PolarHBondContact O-N 3.07Å
353	L	31.4	Very low	31	Very low	85 Å²	85	107.9 Å²	107.9	45%	0.445	55%	0.552	S	S	.	*	H	α-helix	trans	-48.1	-40.2	-177.5	-77	163.7	0	0	0	114.4	S351 N355 L356 C357	S351-L353 PolarHBondContact O-N 2.66Å; L353-N355 VanDerWaalsContact C-N 3.33Å; L353-N355 PolarHBondContact O-N 2.74Å; L353-L356 HydrophobicContact CD2-CD2 4.42Å; L353-L356 WeakPolarHBondContact O-CB 3.47Å; L353-L356 PolarHBondContact O-N 3.36Å; L353-L356 VanDerWaalsContact O-N 3.11Å; L353-C357 PolarHBondContact O-N 3.02Å; L353-C357 PolarHBondContact O-SG 3.49Å
354	I	32.7	Very low	31.2	Very low	99 Å²	99	104 Å²	104	51%	0.508	54%	0.54	S	S	.	.	H	α-helix	trans	-68.1	-34.7	-179	-62.5	178.5	0	0	0	111.5	S351 P352 A358 Y951	S351-I354 PolarHBondContact O-N 3.21Å; P352-I354 VanDerWaalsContact C-N 3.28Å; P352-I354 PolarHBondContact O-N 2.78Å; P352-I354 VanDerWaalsContact O-N 3.13Å; I354-A358 WeakPolarHBondContact O-CB 3.3Å; I354-A358 PolarHBondContact O-N 3.07Å; I354-Y951 HydrophobicContact CD1-CE2 4.18Å
355	N	31.2	Very low	31.6	Very low	98 Å²	98	106.2 Å²	106.2	52%	0.524	54%	0.538	S	S	.	.	H	α-helix	trans	-77.6	-31.4	170.6	-78.7	-39.8	0	0	0	111.7	P352 L353 Q359	P352-N355 CarbonylContact O-C 3.57Å; P352-N355 WeakPolarHBondContact O-CA 3.4Å; P352-N355 PolarHBondContact O-N 2.85Å; L353-N355 VanDerWaalsContact C-N 3.33Å; L353-N355 PolarHBondContact O-N 2.74Å; N355-Q359 WeakPolarHBondContact O-CB 3.49Å; N355-Q359 VanDerWaalsContact O-CG 3.27Å; N355-Q359 WeakPolarHBondContact O-CG 3.39Å; N355-Q359 PolarHBondContact O-N 3.42Å; N355-Q359 VanDerWaalsContact O-N 3.09Å
356	L	30.6	Very low	31.6	Very low	52 Å²	52	109.2 Å²	109.2	27%	0.272	54%	0.539	S	S	.	.	H	α-helix	trans	-64.4	-55.3	178.6	-150.3	77.9	0	0	0	110.5	P352 L353 A358 Q359 L360 M676	P352-L356 PolarHBondContact O-N 3.07Å; L353-L356 HydrophobicContact CD2-CD2 4.42Å; L353-L356 WeakPolarHBondContact O-CB 3.47Å; L353-L356 PolarHBondContact O-N 3.36Å; L353-L356 VanDerWaalsContact O-N 3.11Å; L356-A358 VanDerWaalsContact C-N 3.3Å; L356-A358 PolarHBondContact O-N 3.05Å; L356-Q359 CarbonylContact O-C 3.55Å; L356-Q359 PolarHBondContact O-N 3.05Å; L356-L360 HydrophobicContact CB-CD1 4.5Å; L356-L360 HydrophobicContact CD2-CD1 3.94Å; L356-L360 HydrophobicContact CG-CD1 3.76Å; L356-L360 HydrophobicContact CG-CG 4.25Å; L356-L360 WeakPolarHBondContact O-CB 3.41Å; L356-L360 VanDerWaalsContact O-CG 3.32Å; L356-L360 WeakPolarHBondContact O-CG 3.48Å; L356-L360 PolarHBondContact O-N 2.85Å; L356-M676 HydrophobicContact CD1-SD 4.24Å
357	C	30.6	Very low	31.8	Very low	47 Å²	47	108.1 Å²	108.1	32%	0.318	53%	0.534	S	S	.	.	H	α-helix	trans	-56.5	-43.1	176.1	-60	0	0	0	0	111.9	L353 Q359 L360 F361	L353-C357 PolarHBondContact O-N 3.02Å; L353-C357 PolarHBondContact O-SG 3.49Å; C357-Q359 PolarHBondContact O-N 2.97Å; C357-L360 PolarHBondContact O-N 2.94Å; C357-F361 WeakPolarHBondContact O-CD2 3.15Å; C357-F361 PolarHBondContact O-N 3.49Å
358	A	33.6	Very low	31.9	Very low	68 Å²	68	106.6 Å²	106.6	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-65.4	-19.9	177.8	0	0	0	0	0	114	I354 L356 P362	I354-A358 WeakPolarHBondContact O-CB 3.3Å; I354-A358 PolarHBondContact O-N 3.07Å; L356-A358 VanDerWaalsContact C-N 3.3Å; L356-A358 PolarHBondContact O-N 3.05Å; A358-P362 WeakPolarHBondContact O-CD 3.45Å
359	Q	35.2	Very low	32	Very low	83 Å²	83	105.8 Å²	105.8	39%	0.388	53%	0.532	S	S	.	.	H	α-helix	trans	-100	-28.1	174.7	-70.5	178.2	49.8	0	0	113.6	N355 L356 C357 R363	N355-Q359 WeakPolarHBondContact O-CB 3.49Å; N355-Q359 VanDerWaalsContact O-CG 3.27Å; N355-Q359 WeakPolarHBondContact O-CG 3.39Å; N355-Q359 PolarHBondContact O-N 3.42Å; N355-Q359 VanDerWaalsContact O-N 3.09Å; L356-Q359 CarbonylContact O-C 3.55Å; L356-Q359 PolarHBondContact O-N 3.05Å; C357-Q359 PolarHBondContact O-N 2.97Å; Q359-R363 WeakPolarHBondContact O-CB 3.38Å; Q359-R363 WeakPolarHBondContact O-CD 3.37Å; Q359-R363 WeakPolarHBondContact O-CG 3.44Å; Q359-R363 PolarHBondContact O-N 2.73Å
360	L	32.1	Very low	31.8	Very low	40 Å²	40	102.4 Å²	102.4	21%	0.209	53%	0.526	C	S	.	.	H	α-helix	trans	-75.6	-46.6	-178	-76.2	172	0	0	0	112.6	L356 C357 P362 R363 L364	L356-L360 HydrophobicContact CB-CD1 4.5Å; L356-L360 HydrophobicContact CD2-CD1 3.94Å; L356-L360 HydrophobicContact CG-CD1 3.76Å; L356-L360 HydrophobicContact CG-CG 4.25Å; L356-L360 WeakPolarHBondContact O-CB 3.41Å; L356-L360 VanDerWaalsContact O-CG 3.32Å; L356-L360 WeakPolarHBondContact O-CG 3.48Å; L356-L360 PolarHBondContact O-N 2.85Å; C357-L360 PolarHBondContact O-N 2.94Å; L360-P362 VanDerWaalsContact C-N 3.29Å; L360-R363 PolarHBondContact O-N 2.98Å; L360-L364 PolarHBondContact O-N 3.45Å; L360-L364 VanDerWaalsContact O-N 3.11Å
361	F	32.9	Very low	31.5	Very low	133 Å²	133	101.7 Å²	101.7	58%	0.583	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-34.9	179.6	-80.7	-69.3	0	0	0	113.6	C357	C357-F361 WeakPolarHBondContact O-CD2 3.15Å; C357-F361 PolarHBondContact O-N 3.49Å
362	P	35.7	Very low	31.5	Very low	67 Å²	67	102 Å²	102	44%	0.435	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-14.6	169.2	-18.4	33.7	0	0	0	116	A358 L360 R366	A358-P362 WeakPolarHBondContact O-CD 3.45Å; L360-P362 VanDerWaalsContact C-N 3.29Å; P362-R366 VanDerWaalsContact O-CG 3.31Å; P362-R366 WeakPolarHBondContact O-CG 3.43Å
363	R	30.6	Very low	31.4	Very low	122 Å²	122	104.9 Å²	104.9	46%	0.46	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-42	-179.1	-85.6	175.8	-178.5	142.9	10.2	112.5	Q359 L360 F365 R366	Q359-R363 WeakPolarHBondContact O-CB 3.38Å; Q359-R363 WeakPolarHBondContact O-CD 3.37Å; Q359-R363 WeakPolarHBondContact O-CG 3.44Å; Q359-R363 PolarHBondContact O-N 2.73Å; L360-R363 PolarHBondContact O-N 2.98Å; R363-F365 PolarHBondContact O-N 3.04Å; R363-R366 PolarHBondContact O-N 3.32Å; R363-R366 VanDerWaalsContact O-N 3.08Å
364	L	32.1	Very low	31.6	Very low	125 Å²	125	109 Å²	109	65%	0.654	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-14.3	177.8	-73.1	168.4	0	0	0	114.3	L360	L360-L364 PolarHBondContact O-N 3.45Å; L360-L364 VanDerWaalsContact O-N 3.11Å
365	F	34.9	Very low	31.7	Very low	142 Å²	142	108.9 Å²	108.9	62%	0.623	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.3	20.7	177.9	-63.4	-77.6	0	0	0	113.3	R363 Q367	R363-F365 PolarHBondContact O-N 3.04Å; F365-Q367 PolarHBondContact O-N 2.84Å
366	R	27.9	Very low	32	Very low	202 Å²	202	107.6 Å²	107.6	76%	0.762	56%	0.557	S	S	*	*			trans	-94.7	74	172.6	-93.8	176.6	173.3	-138.8	-1.3	111.8	P362 R363	P362-R366 VanDerWaalsContact O-CG 3.31Å; P362-R366 WeakPolarHBondContact O-CG 3.43Å; R363-R366 PolarHBondContact O-N 3.32Å; R363-R366 VanDerWaalsContact O-N 3.08Å
367	Q	32.3	Very low	32.2	Very low	132 Å²	132	112.7 Å²	112.7	62%	0.617	59%	0.585	S	S	*	*			trans	-100.1	153.9	150.8	-75.1	-173.8	-22.8	0	0	109.4	F365 E369	F365-Q367 PolarHBondContact O-N 2.84Å; Q367-E369 PolarHBondContact O-N 3.11Å
368	N	28.5	Very low	32.5	Very low	155 Å²	155	111.5 Å²	111.5	83%	0.829	58%	0.581	S	S	*	*			trans	-82.8	44.2	-159	-68.2	-42.3	0	0	0	114.9	S370	N368-S370 PolarHBondContact O-N 3.28Å; N368-S370 VanDerWaalsContact O-N 3.13Å
369	E	30	Very low	32.8	Very low	124 Å²	124	110.5 Å²	110.5	58%	0.579	56%	0.564	S	S	*	*			trans	-81.2	88.5	174.7	-64.3	-169.6	125.6	0	0	110.9	Q367 R928	Q367-E369 PolarHBondContact O-N 3.11Å; E369-R928 IonicContact OE2-CZ 2.31Å; E369-R928 IonicContact OE2-NH1 3.14Å; E369-R928 PolarHBondContact OE2-NH1 2.83Å; E369-R928 IonicContact OE2-NH2 2.74Å; E369-R928 PolarHBondContact OE2-NH2 3.35Å
370	S	27.5	Very low	32.9	Very low	84 Å²	84	111.9 Å²	111.9	59%	0.587	57%	0.573	S	S	*	*			trans	-68.1	131.5	167.2	68.7	0	0	0	0	110.3	N368	N368-S370 PolarHBondContact O-N 3.28Å; N368-S370 VanDerWaalsContact O-N 3.13Å
371	S	27.8	Very low	33.2	Very low	115 Å²	115	112.8 Å²	112.8	80%	0.804	58%	0.581	S	S	*	*			trans	71.4	87.1	-176.4	70.1	0	0	0	0	117.6
372	S	31	Very low	33.6	Very low	71 Å²	71	113 Å²	113	50%	0.497	58%	0.578	S	S	.	*			trans	-149.1	145.1	151.7	70.7	0	0	0	0	111.6	Y374	S372-Y374 VanDerWaalsContact C-N 3.33Å; S372-Y374 PolarHBondContact O-N 2.89Å
373	N	30.1	Very low	33.7	Very low	158 Å²	158	113.9 Å²	113.9	85%	0.845	58%	0.578	S	S	*	*			trans	-91.2	25.1	-167.9	-70.6	-69.9	0	0	0	114.1
374	Y	35.8	Very low	34.1	Very low	171 Å²	171	114.5 Å²	114.5	67%	0.671	59%	0.586	S	S	*	*			trans	-86	-10	-167.6	-67.7	-67.5	0	0	0	116	S372 A929	S372-Y374 VanDerWaalsContact C-N 3.33Å; S372-Y374 PolarHBondContact O-N 2.89Å; Y374-A929 HydrophobicContact CD1-CB 4.39Å; Y374-A929 HydrophobicContact CE1-CB 4.33Å
375	L	34.7	Very low	34.5	Very low	98 Å²	98	116.9 Å²	116.9	51%	0.513	59%	0.587	S	S	.	*	S	Bend	trans	-90.7	134.1	166.8	-73.6	173.5	0	0	0	110.1	N377 F379	L375-N377 PolarHBondContact O-N 2.96Å; L375-F379 HydrophobicContact CD2-CD1 4.24Å
376	S	37.8	Very low	34.7	Very low	71 Å²	71	114 Å²	114	50%	0.497	58%	0.578	S	S	.	*			trans	-53.3	129.4	170	179.9	0	0	0	0	110.3	G378 F379	S376-G378 PolarHBondContact O-N 3.36Å; S376-G378 PolarHBondContact OG-N 3.26Å; S376-F379 WeakPolarHBondContact O-CB 3.37Å; S376-F379 PolarHBondContact O-N 3.4Å
377	N	36.1	Very low	35	Very low	159 Å²	159	107.5 Å²	107.5	85%	0.85	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-11.7	175.2	-85.5	-43.4	0	0	0	113.9	L375	L375-N377 PolarHBondContact O-N 2.96Å
378	G	36.3	Very low	35.3	Very low	22 Å²	22	104.5 Å²	104.5	23%	0.227	55%	0.553	C	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	-13.9	171.4	0	0	0	0	0	116.2	S376 R382	S376-G378 PolarHBondContact O-N 3.36Å; S376-G378 PolarHBondContact OG-N 3.26Å; G378-R382 WeakPolarHBondContact O-CB 3.19Å; G378-R382 WeakPolarHBondContact O-CD 3.32Å; G378-R382 WeakPolarHBondContact O-CG 3.34Å; G378-R382 PolarHBondContact O-N 2.87Å
379	F	39.5	Very low	35.8	Very low	47 Å²	47	100.8 Å²	100.8	21%	0.206	53%	0.534	C	S	.	.	H	α-helix	trans	-65	-62.6	-165.2	-171.7	-101.3	0	0	0	113.6	L375 S376 R382 I383	L375-F379 HydrophobicContact CD2-CD1 4.24Å; S376-F379 WeakPolarHBondContact O-CB 3.37Å; S376-F379 PolarHBondContact O-N 3.4Å; F379-R382 WeakPolarHBondContact O-CB 3.44Å; F379-R382 PolarHBondContact O-N 3.16Å; F379-I383 HydrophobicContact CD1-CD1 3.96Å; F379-I383 HydrophobicContact CE1-CD1 3.46Å; F379-I383 VanDerWaalsContact CE1-CD1 3.46Å; F379-I383 HydrophobicContact CE2-CD1 4.28Å; F379-I383 HydrophobicContact CZ-CD1 3.65Å; F379-I383 PolarHBondContact O-N 2.95Å
380	L	37.7	Very low	36.3	Very low	112 Å²	112	97.9 Å²	97.9	59%	0.586	53%	0.525	S	S	*	.	H	α-helix	trans	-58.5	-44.5	176.6	-77.8	164.9	0	0	0	112.6	R382 I383 Q384	L380-R382 VanDerWaalsContact C-N 3.32Å; L380-R382 PolarHBondContact O-N 2.93Å; L380-I383 PolarHBondContact O-N 3.4Å; L380-Q384 PolarHBondContact O-N 2.31Å
381	P	38.2	Very low	36.5	Very low	59 Å²	59	99.8 Å²	99.8	38%	0.383	52%	0.523	S	S	.	.	H	α-helix	trans	-60.6	-32.8	171.5	-27.1	35.9	0	0	0	114.8	R385	P381-R385 WeakPolarHBondContact O-CB 3.16Å; P381-R385 WeakPolarHBondContact O-CD 3.47Å; P381-R385 WeakPolarHBondContact O-CG 3.48Å; P381-R385 PolarHBondContact O-N 3.21Å
382	R	40.8	Very low	36.7	Very low	138 Å²	138	102.2 Å²	102.2	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-70	-45.9	174.8	-80.6	170	-177.3	-172.4	1.7	110.9	G378 F379 L380 Q384 R385 L386	G378-R382 WeakPolarHBondContact O-CB 3.19Å; G378-R382 WeakPolarHBondContact O-CD 3.32Å; G378-R382 WeakPolarHBondContact O-CG 3.34Å; G378-R382 PolarHBondContact O-N 2.87Å; F379-R382 WeakPolarHBondContact O-CB 3.44Å; F379-R382 PolarHBondContact O-N 3.16Å; L380-R382 VanDerWaalsContact C-N 3.32Å; L380-R382 PolarHBondContact O-N 2.93Å; R382-Q384 PolarHBondContact O-N 3.42Å; R382-R385 CarbonylContact O-C 3.58Å; R382-R385 WeakPolarHBondContact O-CB 3.31Å; R382-R385 PolarHBondContact O-N 2.89Å; R382-R385 VanDerWaalsContact O-N 3.11Å; R382-L386 WeakPolarHBondContact O-CG 3.33Å; R382-L386 PolarHBondContact O-N 3.46Å
383	I	39	Very low	37.1	Very low	84 Å²	84	105.4 Å²	105.4	43%	0.431	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-43.8	177.2	-68.1	177.5	0	0	0	111	F379 L380 R385 L386 S387	F379-I383 HydrophobicContact CD1-CD1 3.96Å; F379-I383 HydrophobicContact CE1-CD1 3.46Å; F379-I383 VanDerWaalsContact CE1-CD1 3.46Å; F379-I383 HydrophobicContact CE2-CD1 4.28Å; F379-I383 HydrophobicContact CZ-CD1 3.65Å; F379-I383 PolarHBondContact O-N 2.95Å; L380-I383 PolarHBondContact O-N 3.4Å; I383-R385 VanDerWaalsContact C-N 3.35Å; I383-R385 PolarHBondContact O-N 2.84Å; I383-L386 PolarHBondContact O-N 2.84Å; I383-S387 PolarHBondContact O-N 3.49Å; I383-S387 PolarHBondContact O-OG 2.89Å
384	Q	38.9	Very low	37.7	Very low	135 Å²	135	100.8 Å²	100.8	63%	0.631	49%	0.493	S	S	*	.	H	α-helix	trans	-64.5	-34.9	173.6	-72.6	-174.1	-12.1	0	0	113.2	L380 R382 S387 T388	L380-Q384 PolarHBondContact O-N 2.31Å; R382-Q384 PolarHBondContact O-N 3.42Å; Q384-S387 PolarHBondContact O-OG 3.44Å; Q384-T388 WeakPolarHBondContact O-CB 3.32Å; Q384-T388 WeakPolarHBondContact O-CG2 3.47Å; Q384-T388 PolarHBondContact O-N 3.01Å; Q384-T388 VanDerWaalsContact O-N 3.08Å; Q384-T388 PolarHBondContact O-OG1 3.12Å
385	R	39.8	Very low	38.2	Very low	176 Å²	176	98.9 Å²	98.9	66%	0.664	49%	0.488	S	S	*	.	H	α-helix	trans	-69.1	-35.4	172.6	-77.1	171.3	-177.7	-169.5	2.6	112.2	P381 R382 I383 T388 N389	P381-R385 WeakPolarHBondContact O-CB 3.16Å; P381-R385 WeakPolarHBondContact O-CD 3.47Å; P381-R385 WeakPolarHBondContact O-CG 3.48Å; P381-R385 PolarHBondContact O-N 3.21Å; R382-R385 CarbonylContact O-C 3.58Å; R382-R385 WeakPolarHBondContact O-CB 3.31Å; R382-R385 PolarHBondContact O-N 2.89Å; R382-R385 VanDerWaalsContact O-N 3.11Å; I383-R385 VanDerWaalsContact C-N 3.35Å; I383-R385 PolarHBondContact O-N 2.84Å; R385-T388 WeakPolarHBondContact CA-OG1 3.38Å; R385-T388 PolarHBondContact O-OG1 2.88Å; R385-N389 WeakPolarHBondContact O-CB 3.39Å; R385-N389 PolarHBondContact O-N 3.49Å; R385-N389 PolarHBondContact O-ND2 3.3Å; R385-N389 VanDerWaalsContact O-ND2 3.12Å
386	L	39.3	Very low	38.6	Very low	82 Å²	82	103.3 Å²	103.3	43%	0.429	50%	0.498	S	S	.	.	H	α-helix	trans	-68.1	-50.3	176.4	-72.5	168.7	0	0	0	111	R382 I383 T388 N389 T390	R382-L386 WeakPolarHBondContact O-CG 3.33Å; R382-L386 PolarHBondContact O-N 3.46Å; I383-L386 PolarHBondContact O-N 2.84Å; L386-T388 PolarHBondContact O-N 2.86Å; L386-N389 PolarHBondContact O-N 2.79Å; L386-N389 VanDerWaalsContact O-N 3.08Å; L386-T390 PolarHBondContact O-N 2.99Å; L386-T390 PolarHBondContact O-OG1 3.34Å
387	S	34.7	Very low	39.3	Very low	65 Å²	65	108.1 Å²	108.1	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-63.3	-38.4	178.2	65.9	0	0	0	0	112.8	I383 Q384 T390 F391	I383-S387 PolarHBondContact O-N 3.49Å; I383-S387 PolarHBondContact O-OG 2.89Å; Q384-S387 PolarHBondContact O-OG 3.44Å; S387-T390 PolarHBondContact O-OG1 2.79Å; S387-F391 WeakPolarHBondContact O-CB 3.31Å; S387-F391 PolarHBondContact O-N 3.27Å; S387-F391 VanDerWaalsContact O-N 3.08Å
388	T	38.8	Very low	40.1	Very low	68 Å²	68	106.7 Å²	106.7	42%	0.417	50%	0.496	S	S	.	.	H	α-helix	trans	-71.5	-28.6	173.2	54.2	0	0	0	0	113	Q384 R385 L386 R392	Q384-T388 WeakPolarHBondContact O-CB 3.32Å; Q384-T388 WeakPolarHBondContact O-CG2 3.47Å; Q384-T388 PolarHBondContact O-N 3.01Å; Q384-T388 VanDerWaalsContact O-N 3.08Å; Q384-T388 PolarHBondContact O-OG1 3.12Å; R385-T388 WeakPolarHBondContact CA-OG1 3.38Å; R385-T388 PolarHBondContact O-OG1 2.88Å; L386-T388 PolarHBondContact O-N 2.86Å; T388-R392 VanDerWaalsContact O-CB 3.31Å; T388-R392 WeakPolarHBondContact O-CB 3.42Å; T388-R392 WeakPolarHBondContact O-CD 3.05Å; T388-R392 WeakPolarHBondContact O-CG 3.34Å; T388-R392 PolarHBondContact O-N 3.02Å
389	N	38.7	Very low	40.7	Very low	77 Å²	77	115 Å²	115	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-75.2	-38.8	174.4	-79.8	-25	0	0	0	113	R385 L386 R392 R393	R385-N389 WeakPolarHBondContact O-CB 3.39Å; R385-N389 PolarHBondContact O-N 3.49Å; R385-N389 PolarHBondContact O-ND2 3.3Å; R385-N389 VanDerWaalsContact O-ND2 3.12Å; L386-N389 PolarHBondContact O-N 2.79Å; L386-N389 VanDerWaalsContact O-N 3.08Å; N389-R392 PolarHBondContact O-N 2.93Å; N389-R393 WeakPolarHBondContact O-CB 3.44Å; N389-R393 WeakPolarHBondContact O-CG 3.14Å; N389-R393 PolarHBondContact O-N 3.35Å
390	T	39.3	Very low	41.1	Very low	64 Å²	64	116.6 Å²	116.6	39%	0.393	53%	0.534	S	S	.	.	H	α-helix	trans	-63.7	-45.7	171.6	54.6	0	0	0	0	110.3	L386 S387 R392 R393 V394	L386-T390 PolarHBondContact O-N 2.99Å; L386-T390 PolarHBondContact O-OG1 3.34Å; S387-T390 PolarHBondContact O-OG1 2.79Å; T390-R392 VanDerWaalsContact C-N 3.29Å; T390-R392 PolarHBondContact O-N 3.47Å; T390-R393 PolarHBondContact O-N 2.84Å; T390-R393 VanDerWaalsContact O-N 3.08Å; T390-V394 WeakPolarHBondContact O-CG2 3.49Å; T390-V394 PolarHBondContact O-N 2.74Å
391	F	32.7	Very low	41.1	Very low	124 Å²	124	113.2 Å²	113.2	54%	0.544	52%	0.522	S	S	.	.	H	α-helix	trans	-60.3	-36.7	175.6	-147.1	-104.4	0	0	0	112.8	S387 K395	S387-F391 WeakPolarHBondContact O-CB 3.31Å; S387-F391 PolarHBondContact O-N 3.27Å; S387-F391 VanDerWaalsContact O-N 3.08Å; F391-K395 HydrophobicContact CD1-CD 4.23Å; F391-K395 HydrophobicContact CE1-CD 4.31Å; F391-K395 VanDerWaalsContact CE1-CE 3.48Å; F391-K395 WeakPolarHBondContact O-CB 3.36Å; F391-K395 WeakPolarHBondContact O-CG 3.46Å; F391-K395 PolarHBondContact O-N 3.28Å
392	R	32.5	Very low	41.5	Very low	166 Å²	166	118.4 Å²	118.4	63%	0.626	53%	0.534	S	S	*	.	H	α-helix	trans	-69.8	-39.1	172.5	-77.5	167.7	174.7	-171.8	-2.6	112.8	T388 N389 T390 R396	T388-R392 VanDerWaalsContact O-CB 3.31Å; T388-R392 WeakPolarHBondContact O-CB 3.42Å; T388-R392 WeakPolarHBondContact O-CD 3.05Å; T388-R392 WeakPolarHBondContact O-CG 3.34Å; T388-R392 PolarHBondContact O-N 3.02Å; N389-R392 PolarHBondContact O-N 2.93Å; T390-R392 VanDerWaalsContact C-N 3.29Å; T390-R392 PolarHBondContact O-N 3.47Å; R392-R396 WeakPolarHBondContact O-CB 3.33Å; R392-R396 WeakPolarHBondContact O-CG 3.15Å; R392-R396 PolarHBondContact O-N 3.12Å
393	R	39.2	Very low	42	Very low	138 Å²	138	120.7 Å²	120.7	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-65.3	-45.5	174.8	-79.4	172.4	166.3	-172.1	-6.5	111.3	N389 T390 R396 K397 D948	N389-R393 WeakPolarHBondContact O-CB 3.44Å; N389-R393 WeakPolarHBondContact O-CG 3.14Å; N389-R393 PolarHBondContact O-N 3.35Å; T390-R393 PolarHBondContact O-N 2.84Å; T390-R393 VanDerWaalsContact O-N 3.08Å; R393-R396 CarbonylContact O-C 3.55Å; R393-R396 WeakPolarHBondContact O-CA 3.23Å; R393-R396 WeakPolarHBondContact O-CB 3.25Å; R393-R396 PolarHBondContact O-N 2.85Å; R393-R396 VanDerWaalsContact O-N 3.12Å; R393-K397 PolarHBondContact O-N 3.35Å; R393-D948 IonicContact CZ-OD1 3.27Å; R393-D948 IonicContact CZ-OD2 3Å; R393-D948 VanDerWaalsContact CZ-OD2 3.29Å; R393-D948 IonicContact NH1-OD1 2.98Å; R393-D948 PolarHBondContact NH1-OD1 2.86Å; R393-D948 IonicContact NH1-OD2 2.63Å; R393-D948 PolarHBondContact NH1-OD2 2.83Å; R393-D948 IonicContact NH2-OD2 3.92Å; R393-D948 PolarHBondContact NH2-OD2 2.81Å
394	V	41.2	Very low	42.3	Very low	61 Å²	61	121.8 Å²	121.8	37%	0.37	55%	0.549	S	S	.	.	H	α-helix	trans	-61.2	-46.3	174.6	173.1	0	0	0	0	110.9	T390 R396 K397 K398	T390-V394 WeakPolarHBondContact O-CG2 3.49Å; T390-V394 PolarHBondContact O-N 2.74Å; V394-R396 VanDerWaalsContact C-N 3.27Å; V394-R396 PolarHBondContact O-N 3.4Å; V394-K397 PolarHBondContact O-N 2.88Å; V394-K398 WeakPolarHBondContact O-CB 3.42Å; V394-K398 PolarHBondContact O-N 3.08Å
395	K	46.9	Very low	42.5	Very low	131 Å²	131	119.4 Å²	119.4	57%	0.57	54%	0.541	S	S	*	.	H	α-helix	trans	-63.9	-27	173.9	-78.4	-174.7	174.5	-177.8	0	113.8	F391 R399	F391-K395 HydrophobicContact CD1-CD 4.23Å; F391-K395 HydrophobicContact CE1-CD 4.31Å; F391-K395 VanDerWaalsContact CE1-CE 3.48Å; F391-K395 WeakPolarHBondContact O-CB 3.36Å; F391-K395 WeakPolarHBondContact O-CG 3.46Å; F391-K395 PolarHBondContact O-N 3.28Å; K395-R399 WeakPolarHBondContact O-CB 3.18Å; K395-R399 WeakPolarHBondContact O-CG 3.37Å; K395-R399 PolarHBondContact O-N 3.07Å
396	R	43.5	Very low	43	Very low	190 Å²	190	117.8 Å²	117.8	72%	0.717	54%	0.538	S	S	*	.	H	α-helix	trans	-72.2	-54.1	168.6	-78.5	178.8	176.3	178.9	-1.6	110.9	R392 R393 V394 K398 R399 T400	R392-R396 WeakPolarHBondContact O-CB 3.33Å; R392-R396 WeakPolarHBondContact O-CG 3.15Å; R392-R396 PolarHBondContact O-N 3.12Å; R393-R396 CarbonylContact O-C 3.55Å; R393-R396 WeakPolarHBondContact O-CA 3.23Å; R393-R396 WeakPolarHBondContact O-CB 3.25Å; R393-R396 PolarHBondContact O-N 2.85Å; R393-R396 VanDerWaalsContact O-N 3.12Å; V394-R396 VanDerWaalsContact C-N 3.27Å; V394-R396 PolarHBondContact O-N 3.4Å; R396-K398 VanDerWaalsContact C-N 3.3Å; R396-K398 PolarHBondContact O-N 2.78Å; R396-R399 CarbonylContact O-C 3.52Å; R396-R399 WeakPolarHBondContact O-CA 3.12Å; R396-R399 WeakPolarHBondContact O-CB 3.05Å; R396-R399 PolarHBondContact O-N 2.89Å; R396-T400 PolarHBondContact O-N 2.95Å; R396-T400 PolarHBondContact O-OG1 2.97Å; R396-T400 VanDerWaalsContact O-OG1 3.11Å
397	K	52.3	Low	43.3	Very low	173 Å²	173	119 Å²	119	75%	0.752	54%	0.544	S	S	*	.	H	α-helix	trans	-54.7	-43.7	179.5	-158.3	-178.7	-177.2	-169.8	0	111.7	R393 V394 R399 T400 A401	R393-K397 PolarHBondContact O-N 3.35Å; V394-K397 PolarHBondContact O-N 2.88Å; K397-R399 VanDerWaalsContact C-N 3.33Å; K397-R399 PolarHBondContact O-N 3.45Å; K397-T400 PolarHBondContact O-N 3.39Å; K397-A401 WeakPolarHBondContact O-CB 3.42Å; K397-A401 PolarHBondContact O-N 3.18Å
398	K	52.3	Low	43.6	Very low	129 Å²	129	119.6 Å²	119.6	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-73	-16.2	176	-161.5	156.9	-176.5	157.9	0	114.4	V394 R396 R402	V394-K398 WeakPolarHBondContact O-CB 3.42Å; V394-K398 PolarHBondContact O-N 3.08Å; R396-K398 VanDerWaalsContact C-N 3.3Å; R396-K398 PolarHBondContact O-N 2.78Å; K398-R402 WeakPolarHBondContact O-CB 3.17Å; K398-R402 WeakPolarHBondContact O-CD 3.41Å; K398-R402 VanDerWaalsContact O-CG 3.3Å; K398-R402 WeakPolarHBondContact O-CG 3.49Å; K398-R402 PolarHBondContact O-N 3.29Å
399	R	49.3	Very low	43.8	Very low	197 Å²	197	121.9 Å²	121.9	74%	0.743	56%	0.558	S	S	*	*	H	α-helix	trans	-86.5	-30.2	166.4	-85.2	-177.6	171	-170.6	-3	112.7	K395 R396 K397 R403	K395-R399 WeakPolarHBondContact O-CB 3.18Å; K395-R399 WeakPolarHBondContact O-CG 3.37Å; K395-R399 PolarHBondContact O-N 3.07Å; R396-R399 CarbonylContact O-C 3.52Å; R396-R399 WeakPolarHBondContact O-CA 3.12Å; R396-R399 WeakPolarHBondContact O-CB 3.05Å; R396-R399 PolarHBondContact O-N 2.89Å; K397-R399 VanDerWaalsContact C-N 3.33Å; K397-R399 PolarHBondContact O-N 3.45Å; R399-R403 PolarHBondContact O-N 3.12Å; R399-R403 VanDerWaalsContact O-N 3.14Å
400	T	48.3	Very low	44	Very low	79 Å²	79	123.5 Å²	123.5	49%	0.485	56%	0.563	S	S	.	*	H	α-helix	trans	-72.1	-45.8	174	-47.3	0	0	0	0	110.5	R396 K397 R403 L404	R396-T400 PolarHBondContact O-N 2.95Å; R396-T400 PolarHBondContact O-OG1 2.97Å; R396-T400 VanDerWaalsContact O-OG1 3.11Å; K397-T400 PolarHBondContact O-N 3.39Å; T400-R403 CarbonylContact O-C 3.59Å; T400-R403 WeakPolarHBondContact O-CA 3.19Å; T400-R403 WeakPolarHBondContact O-CB 3.36Å; T400-R403 PolarHBondContact O-N 3.42Å; T400-L404 HydrophobicContact CG2-CD1 4.26Å; T400-L404 WeakPolarHBondContact O-CG 3.35Å; T400-L404 PolarHBondContact O-N 3.16Å
401	A	38.6	Very low	43.8	Very low	42 Å²	42	123.4 Å²	123.4	35%	0.347	57%	0.569	S	S	.	*	H	α-helix	trans	-53.1	-57.5	170.9	0	0	0	0	0	110.7	K397 R403 L404 D405	K397-A401 WeakPolarHBondContact O-CB 3.42Å; K397-A401 PolarHBondContact O-N 3.18Å; A401-R403 CarbonylContact O-C 3.58Å; A401-R403 PolarHBondContact O-N 3.49Å; A401-L404 CarbonylContact O-C 3.6Å; A401-L404 WeakPolarHBondContact O-CA 3.16Å; A401-L404 PolarHBondContact O-N 2.92Å; A401-D405 VanDerWaalsContact C-OD2 3.3Å; A401-D405 PolarHBondContact O-N 2.82Å
402	R	46.5	Very low	44.1	Very low	167 Å²	167	120.6 Å²	120.6	63%	0.63	57%	0.565	S	S	*	*	H	α-helix	trans	-61.5	-5.7	174.4	-72	179.7	171.8	-166.4	-3.6	116.4	K398 D405 K406	K398-R402 WeakPolarHBondContact O-CB 3.17Å; K398-R402 WeakPolarHBondContact O-CD 3.41Å; K398-R402 VanDerWaalsContact O-CG 3.3Å; K398-R402 WeakPolarHBondContact O-CG 3.49Å; K398-R402 PolarHBondContact O-N 3.29Å; R402-D405 WeakPolarHBondContact CA-OD2 3.26Å; R402-D405 PolarHBondContact N-OD2 2.85Å; R402-K406 WeakPolarHBondContact O-CG 3.49Å
403	R	51	Low	44.4	Very low	187 Å²	187	118.2 Å²	118.2	71%	0.706	57%	0.568	S	S	*	*	H	α-helix	trans	-95.4	-41.3	166.8	-88.7	-176.3	165.4	-169.6	-6.8	111	R399 T400 A401 K406 I407	R399-R403 PolarHBondContact O-N 3.12Å; R399-R403 VanDerWaalsContact O-N 3.14Å; T400-R403 CarbonylContact O-C 3.59Å; T400-R403 WeakPolarHBondContact O-CA 3.19Å; T400-R403 WeakPolarHBondContact O-CB 3.36Å; T400-R403 PolarHBondContact O-N 3.42Å; A401-R403 CarbonylContact O-C 3.58Å; A401-R403 PolarHBondContact O-N 3.49Å; R403-K406 PolarHBondContact O-N 3.48Å; R403-I407 WeakPolarHBondContact O-CB 3.28Å; R403-I407 WeakPolarHBondContact O-CD1 3.2Å; R403-I407 WeakPolarHBondContact O-CG1 3.35Å; R403-I407 PolarHBondContact O-N 2.88Å
404	L	44.1	Very low	44.2	Very low	107 Å²	107	118.9 Å²	118.9	56%	0.56	58%	0.577	S	S	*	*	H	α-helix	trans	-64.2	-43.4	173	-66.4	169.7	0	0	0	111.3	T400 A401 K406 I407 S408	T400-L404 HydrophobicContact CG2-CD1 4.26Å; T400-L404 WeakPolarHBondContact O-CG 3.35Å; T400-L404 PolarHBondContact O-N 3.16Å; A401-L404 CarbonylContact O-C 3.6Å; A401-L404 WeakPolarHBondContact O-CA 3.16Å; A401-L404 PolarHBondContact O-N 2.92Å; L404-K406 PolarHBondContact O-N 3.03Å; L404-I407 PolarHBondContact O-N 2.69Å; L404-S408 VanDerWaalsContact O-CB 3.29Å; L404-S408 WeakPolarHBondContact O-CB 3.18Å; L404-S408 PolarHBondContact O-N 3.48Å
405	D	43	Very low	43.8	Very low	85 Å²	85	122.6 Å²	122.6	46%	0.455	59%	0.591	S	S	.	*	H	α-helix	trans	-56.5	-40.2	172.3	-50	-29.1	0	0	0	111.2	A401 R402 N409	A401-D405 VanDerWaalsContact C-OD2 3.3Å; A401-D405 PolarHBondContact O-N 2.82Å; R402-D405 WeakPolarHBondContact CA-OD2 3.26Å; R402-D405 PolarHBondContact N-OD2 2.85Å; D405-N409 VanDerWaalsContact O-CB 3.25Å; D405-N409 WeakPolarHBondContact O-CB 3.48Å; D405-N409 PolarHBondContact O-N 2.86Å; D405-N409 PolarHBondContact O-ND2 3.36Å
406	K	50.3	Low	43	Very low	141 Å²	141	125 Å²	125	61%	0.613	60%	0.604	S	S	*	*	H	α-helix	trans	-72.9	-40.5	178	-80.9	-171.1	167.6	-129	0	112.7	R402 R403 L404 N409 Q410	R402-K406 WeakPolarHBondContact O-CG 3.49Å; R403-K406 PolarHBondContact O-N 3.48Å; L404-K406 PolarHBondContact O-N 3.03Å; K406-N409 CarbonylContact O-C 3.53Å; K406-N409 PolarHBondContact O-N 3.26Å; K406-Q410 WeakPolarHBondContact O-CB 3.47Å; K406-Q410 VanDerWaalsContact O-CG 3.24Å; K406-Q410 WeakPolarHBondContact O-CG 3.35Å; K406-Q410 PolarHBondContact O-N 3.26Å; K406-Q410 PolarHBondContact O-OE1 3.32Å
407	I	46.6	Very low	42.5	Very low	108 Å²	108	125.4 Å²	125.4	55%	0.554	61%	0.614	S	S	*	*	H	α-helix	trans	-66.2	-41.9	175.7	-67.8	164.3	0	0	0	109.7	R403 L404 N409 Q410 A411	R403-I407 WeakPolarHBondContact O-CB 3.28Å; R403-I407 WeakPolarHBondContact O-CD1 3.2Å; R403-I407 WeakPolarHBondContact O-CG1 3.35Å; R403-I407 PolarHBondContact O-N 2.88Å; L404-I407 PolarHBondContact O-N 2.69Å; I407-N409 PolarHBondContact O-N 3.33Å; I407-Q410 PolarHBondContact O-N 2.8Å; I407-A411 WeakPolarHBondContact O-CB 3.42Å; I407-A411 PolarHBondContact O-N 3.44Å
408	S	39.9	Very low	41.3	Very low	77 Å²	77	125.4 Å²	125.4	54%	0.538	62%	0.617	S	S	.	*	H	α-helix	trans	-63.3	-39.2	175.4	-165	0	0	0	0	112.5	L404 Q410 S412	L404-S408 VanDerWaalsContact O-CB 3.29Å; L404-S408 WeakPolarHBondContact O-CB 3.18Å; L404-S408 PolarHBondContact O-N 3.48Å; S408-Q410 VanDerWaalsContact C-N 3.31Å; S408-S412 PolarHBondContact O-N 3.29Å; S408-S412 PolarHBondContact O-OG 3.45Å
409	N	43.9	Very low	40.2	Very low	116 Å²	116	128.2 Å²	128.2	62%	0.62	63%	0.629	S	S	*	*	H	α-helix	trans	-86	2.9	178.2	-64.9	-7.9	0	0	0	113.9	D405 K406 I407	D405-N409 VanDerWaalsContact O-CB 3.25Å; D405-N409 WeakPolarHBondContact O-CB 3.48Å; D405-N409 PolarHBondContact O-N 2.86Å; D405-N409 PolarHBondContact O-ND2 3.36Å; K406-N409 CarbonylContact O-C 3.53Å; K406-N409 PolarHBondContact O-N 3.26Å; I407-N409 PolarHBondContact O-N 3.33Å
410	Q	43.4	Very low	39.1	Very low	111 Å²	111	126.8 Å²	126.8	52%	0.519	63%	0.628	S	S	.	*	H	α-helix	trans	-107	-40	167.8	-72.8	-178.7	-107.9	0	0	110.5	K406 I407 S408 S412 V413 E414	K406-Q410 WeakPolarHBondContact O-CB 3.47Å; K406-Q410 VanDerWaalsContact O-CG 3.24Å; K406-Q410 WeakPolarHBondContact O-CG 3.35Å; K406-Q410 PolarHBondContact O-N 3.26Å; K406-Q410 PolarHBondContact O-OE1 3.32Å; I407-Q410 PolarHBondContact O-N 2.8Å; S408-Q410 VanDerWaalsContact C-N 3.31Å; Q410-S412 PolarHBondContact O-N 3.03Å; Q410-V413 WeakPolarHBondContact O-CB 3.46Å; Q410-V413 PolarHBondContact O-N 1.93Å; Q410-E414 PolarHBondContact O-N 3.23Å
411	A	34.6	Very low	38.2	Very low	63 Å²	63	130.8 Å²	130.8	52%	0.521	64%	0.641	S	S	.	*	H	α-helix	trans	-62.5	-22.9	175	0	0	0	0	0	113.8	I407 V413	I407-A411 WeakPolarHBondContact O-CB 3.42Å; I407-A411 PolarHBondContact O-N 3.44Å; A411-V413 PolarHBondContact O-N 3.05Å
412	S	38.3	Very low	37.5	Very low	65 Å²	65	136.5 Å²	136.5	46%	0.455	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.3	-7.7	172.3	56.7	0	0	0	0	114.4	K335 S408 Q410	K335-S412 PolarHBondContact NZ-O 2.8Å; S408-S412 PolarHBondContact O-N 3.29Å; S408-S412 PolarHBondContact O-OG 3.45Å; Q410-S412 PolarHBondContact O-N 3.03Å
413	V	39.9	Very low	36.7	Very low	115 Å²	115	135.7 Å²	135.7	70%	0.697	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-33	-175.8	-175.8	0	0	0	0	112.3	Q410 A411 E415	Q410-V413 WeakPolarHBondContact O-CB 3.46Å; Q410-V413 PolarHBondContact O-N 1.93Å; A411-V413 PolarHBondContact O-N 3.05Å; V413-E415 PolarHBondContact O-N 3.39Å
414	E	35.2	Very low	35.6	Very low	152 Å²	152	131.6 Å²	131.6	71%	0.71	67%	0.669	S	S	*	*			trans	-85.6	25.1	-179.8	-67.2	175.7	139	0	0	113.7	Q410 Q416	Q410-E414 PolarHBondContact O-N 3.23Å; E414-Q416 PolarHBondContact O-N 2.95Å
415	E	31.5	Very low	34.6	Very low	140 Å²	140	134.9 Å²	134.9	65%	0.654	69%	0.686	S	S	*	*			trans	-82.1	35.9	178.7	-156.4	177.3	-133	0	0	112.8	K335 V413	K335-E415 VanDerWaalsContact CE-OE2 3.3Å; K335-E415 WeakPolarHBondContact CE-OE2 3.31Å; K335-E415 IonicContact NZ-OE2 2.61Å; K335-E415 PolarHBondContact NZ-OE2 3.02Å; V413-E415 PolarHBondContact O-N 3.39Å
416	Q	31.3	Very low	33.9	Very low	181 Å²	181	141 Å²	141	85%	0.846	71%	0.705	S	S	*	*			trans	-151.1	83.8	171.1	-75.2	-162	-56.1	0	0	110.2	E414	E414-Q416 PolarHBondContact O-N 2.95Å
417	E	33.1	Very low	32.7	Very low	198 Å²	198	140.6 Å²	140.6	93%	0.925	71%	0.714	S	S	*	*				-174.8	113	129.4	-104.9	177.7	-164.8	0	0	111
418	E	27.2	Very low	32	Very low	174 Å²	174	145 Å²	145	81%	0.813	73%	0.73	S	S	*	*			trans	-83.4	113.7	178.4	176.9	-177.4	-153.3	0	0	110.6
419	K	29.4	Very low	31.3	Very low	188 Å²	188	152.9 Å²	152.9	82%	0.817	75%	0.747	S	S	*	*			trans	-156.1	120.5	154.8	-122.1	159.8	-169.8	166.6	0	115.1	H421	K419-H421 PolarHBondContact O-N 3.25Å
420	F	24.2	Very low	30.6	Very low	166 Å²	166	158.6 Å²	158.6	73%	0.728	76%	0.76	S	S	*	*			trans	-70.4	121.6	173.9	-76.7	-105	0	0	0	111.8
421	H	29.9	Very low	29.9	Very low	164 Å²	164	158.3 Å²	158.3	76%	0.759	77%	0.768	S	S	*	*			trans	-140.3	100.9	155.1	-80.4	-62.7	0	0	0	111.3	K419	K419-H421 PolarHBondContact O-N 3.25Å
422	L	24.9	Very low	29.5	Very low	162 Å²	162	160.8 Å²	160.8	85%	0.848	78%	0.782	S	S	*	*			trans	-69.5	127.5	161.6	-85.7	73	0	0	0	108.8
423	I	29.1	Very low	29.2	Very low	150 Å²	150	168.9 Å²	168.9	77%	0.769	80%	0.802	S	S	*	*			trans	-130.7	137.9	164.9	-63	-176.5	0	0	0	108.4
424	P	27.1	Very low	28.7	Very low	101 Å²	101	172.8 Å²	172.8	66%	0.656	81%	0.81	S	S	*	*			trans	-84.5	170.9	-158.6	-13.6	32	0	0	0	115.9	Y426	P424-Y426 PolarHBondContact O-N 3.1Å
425	L	24.1	Very low	28.4	Very low	175 Å²	175	169.5 Å²	169.5	92%	0.916	80%	0.804	S	S	*	*			trans	-50.6	125	168.9	-68.9	165.9	0	0	0	112.2
426	Y	28.3	Very low	28.4	Very low	213 Å²	213	170.3 Å²	170.3	84%	0.835	81%	0.807	S	S	*	*			trans	-132.8	110.6	166.3	-98.3	-81.8	0	0	0	112	P424 K428	P424-Y426 PolarHBondContact O-N 3.1Å; Y426-K428 PolarHBondContact O-N 3.22Å
427	T	26	Very low	28.3	Very low	133 Å²	133	172.5 Å²	172.5	82%	0.816	81%	0.81	S	S	*	*			trans	-73.6	109	175.5	51.4	0	0	0	0	111.3	R429	T427-R429 PolarHBondContact O-N 3.38Å
428	K	30	Very low	28.1	Very low	202 Å²	202	166.2 Å²	166.2	88%	0.878	80%	0.798	S	S	*	*			trans	-79.4	81.9	169.9	-82	-178.5	175.9	170.3	0	111.8	Y426 R430	Y426-K428 PolarHBondContact O-N 3.22Å; K428-R430 PolarHBondContact O-N 3.1Å
429	R	26.6	Very low	28.3	Very low	241 Å²	241	165.3 Å²	165.3	91%	0.909	80%	0.799	S	S	*	*			trans	-58.9	128.7	152.8	-83.2	-178.8	169.2	173.4	-3.6	108.4	T427	T427-R429 PolarHBondContact O-N 3.38Å
430	R	29.5	Very low	28.1	Very low	236 Å²	236	163 Å²	163	89%	0.891	80%	0.8	S	S	*	*			trans	-134.9	150.1	157.3	-85.9	-166	170.5	179.8	-3.9	109.1	K428	K428-R430 PolarHBondContact O-N 3.1Å
431	P	28.5	Very low	28.4	Very low	106 Å²	106	158.3 Å²	158.3	69%	0.688	80%	0.799	S	S	*	*				-99.5	153.1	-126.6	34.8	-37.2	0	0	0	114.4
432	S	26.4	Very low	28.2	Very low	115 Å²	115	157.3 Å²	157.3	80%	0.804	80%	0.798	S	S	*	*			trans	-65.4	132.4	149.4	43.6	0	0	0	0	109.3
433	R	31.1	Very low	28.5	Very low	235 Å²	235	159.8 Å²	159.8	89%	0.887	80%	0.802	S	S	*	*			trans	-129	128.6	156.3	-83	-167.2	169.6	-174.5	-3.6	108.7
434	F	28.7	Very low	28.5	Very low	196 Å²	196	159.2 Å²	159.2	86%	0.86	80%	0.797	S	S	*	*			trans	-78.2	165	175.2	-110.5	-108.3	0	0	0	110.6
435	S	29.8	Very low	28.8	Very low	84 Å²	84	161.3 Å²	161.3	59%	0.587	80%	0.802	S	S	*	*			trans	66.8	132.8	139.1	69.5	0	0	0	0	122.4
436	H	31	Very low	29.2	Very low	156 Å²	156	161.1 Å²	161.1	72%	0.722	79%	0.794	S	S	*	*			trans	87.2	117.1	140.4	-65.6	-36	0	0	0	121.9
437	Y	29.5	Very low	29.3	Very low	228 Å²	228	154.4 Å²	154.4	89%	0.894	79%	0.789	S	S	*	*			trans	49	136	136.4	-69.3	-79.9	0	0	0	122.2
438	G	28.4	Very low	29.5	Very low	66 Å²	66	154.7 Å²	154.7	68%	0.68	79%	0.786	S	S	*	*			trans	133.2	110	142.6	0	0	0	0	0	116.3
439	N	30.9	Very low	29.3	Very low	155 Å²	155	152.2 Å²	152.2	83%	0.829	78%	0.781	S	S	*	*			trans	50.4	122	148.9	-60.1	-8	0	0	0	119.7
440	V	26.7	Very low	29.4	Very low	139 Å²	139	148.2 Å²	148.2	84%	0.842	78%	0.777	S	S	*	*				81	128.7	59.6	172.8	0	0	0	0	112.9
441	G	29.9	Very low	29.1	Very low	68 Å²	68	142.7 Å²	142.7	70%	0.701	77%	0.77	S	S	*	*			trans	136.4	67.4	-169	0	0	0	0	0	110.6
442	L	25.9	Very low	29.1	Very low	142 Å²	142	146.1 Å²	146.1	74%	0.743	77%	0.774	S	S	*	*				49	113.9	82.8	-78.5	173	0	0	0	114.5
443	F	30.2	Very low	29	Very low	214 Å²	214	147.9 Å²	147.9	94%	0.939	77%	0.769	S	S	*	*				-158.6	155.7	120.3	-97.1	-65.2	0	0	0	109.8
444	E	29.1	Very low	28.8	Very low	139 Å²	139	143.4 Å²	143.4	65%	0.65	76%	0.758	S	S	*	*			trans	-99.9	166.4	-164.7	-50.3	-179.7	106.8	0	0	114.4
445	N	33.8	Very low	28.6	Very low	144 Å²	144	140.8 Å²	140.8	77%	0.77	75%	0.749	S	S	*	*				-165.5	102.9	118.1	-104	-53.3	0	0	0	114.3
446	K	32.2	Very low	28.6	Very low	172 Å²	172	145.5 Å²	145.5	75%	0.748	76%	0.761	S	S	*	*			trans	36.6	130.6	135.4	-62.2	171.3	-176.9	173.3	0	120.7
447	G	31.2	Very low	28.4	Very low	71 Å²	71	144.1 Å²	144.1	73%	0.732	76%	0.759	S	S	*	*			trans	-177.7	25.8	175.6	0	0	0	0	0	120
448	N	30.6	Very low	28.4	Very low	140 Å²	140	140.6 Å²	140.6	75%	0.749	76%	0.755	S	S	*	*			trans	48.2	118.6	161.8	-65.5	6.4	0	0	0	119.7
449	L	25.3	Very low	28.3	Very low	149 Å²	149	143.5 Å²	143.5	78%	0.78	75%	0.754	S	S	*	*				63.1	131	83.5	-72.8	158.4	0	0	0	113.1
450	L	28.4	Very low	28.2	Very low	157 Å²	157	143 Å²	143	82%	0.822	75%	0.751	S	S	*	*			cis	-140.1	161	25.7	-111.2	149.9	0	0	0	113.1
451	V	23.2	Very low	28.3	Very low	121 Å²	121	147.2 Å²	147.2	73%	0.733	75%	0.752	S	S	*	*			trans	-104.1	143.4	164.7	171.4	0	0	0	0	108.5
452	K	28.1	Very low	28.2	Very low	178 Å²	178	147.8 Å²	147.8	77%	0.774	75%	0.746	S	S	*	*			trans	-126.7	130.4	155.3	-117.5	-165.5	175.2	-161.7	0	109.4	E454	K452-E454 WeakPolarHBondContact CD-OE1 3.42Å; K452-E454 VanDerWaalsContact CE-OE1 3.3Å; K452-E454 WeakPolarHBondContact CE-OE1 3.41Å; K452-E454 IonicContact NZ-OE1 3.84Å; K452-E454 PolarHBondContact NZ-OE1 3.14Å
453	Q	24.6	Very low	28.2	Very low	152 Å²	152	145.9 Å²	145.9	71%	0.71	74%	0.744	S	S	*	*			trans	-120.6	115.5	172.7	169	-179.7	-19.7	0	0	105.1
454	E	28.1	Very low	28.3	Very low	141 Å²	141	144 Å²	144	66%	0.659	74%	0.738	S	S	*	*			trans	-116.8	103.9	176	-82.2	171.5	178.7	0	0	108.5	K452	K452-E454 WeakPolarHBondContact CD-OE1 3.42Å; K452-E454 VanDerWaalsContact CE-OE1 3.3Å; K452-E454 WeakPolarHBondContact CE-OE1 3.41Å; K452-E454 IonicContact NZ-OE1 3.84Å; K452-E454 PolarHBondContact NZ-OE1 3.14Å
455	E	24.4	Very low	28.2	Very low	141 Å²	141	142.2 Å²	142.2	66%	0.659	74%	0.741	S	S	*	*			trans	-74.9	136.2	163.2	-59.2	176.9	160.7	0	0	108
456	H	29.5	Very low	28.2	Very low	183 Å²	183	140.9 Å²	140.9	85%	0.847	74%	0.743	S	S	*	*			trans	-136.1	104.5	158.5	-101.1	-76.7	0	0	0	110.3
457	N	25.8	Very low	28	Very low	126 Å²	126	140.3 Å²	140.3	67%	0.674	75%	0.748	S	S	*	*			trans	-67	151.5	162.7	-64	-69.1	0	0	0	110
458	L	30.5	Very low	28	Very low	154 Å²	154	146 Å²	146	81%	0.806	75%	0.752	S	S	*	*			trans	177.5	95.3	141.6	-94.2	161.7	0	0	0	105.9
459	L	26.9	Very low	27.8	Very low	128 Å²	128	148.2 Å²	148.2	67%	0.67	76%	0.758	S	S	*	*				70.2	134.1	88.1	-94.4	76.8	0	0	0	115
460	N	28.5	Very low	28	Very low	144 Å²	144	149.8 Å²	149.8	77%	0.77	76%	0.759	S	S	*	*			trans	72.6	143.9	163	-53.8	-31.1	0	0	0	115.7
461	R	29	Very low	27.9	Very low	227 Å²	227	147.8 Å²	147.8	86%	0.857	76%	0.758	S	S	*	*			cis	-148.6	165.8	12.3	-141.1	171.4	-175.8	169.6	-0.9	112.3
462	S	27.5	Very low	28.3	Very low	81 Å²	81	150.3 Å²	150.3	57%	0.566	76%	0.762	S	S	*	*			trans	-23.2	136	166.4	50.4	0	0	0	0	116.8
463	S	26.2	Very low	28.2	Very low	102 Å²	102	150 Å²	150	71%	0.713	77%	0.769	S	S	*	*			cis	72.5	86.1	46.8	83.2	0	0	0	0	115.5
464	H	31.8	Very low	28.4	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.806	77%	0.772	S	S	*	*			trans	-152.7	135.5	146	-77.4	-60	0	0	0	106.6
465	S	26.7	Very low	28.3	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	76%	0.764	S	S	*	*			cis	79	76.1	26.4	89.3	0	0	0	0	115
466	S	33.2	Very low	28.4	Very low	115 Å²	115	149.2 Å²	149.2	80%	0.804	78%	0.775	S	S	*	*			trans	-158.9	120.3	153.6	60.4	0	0	0	0	109.6
467	D	27.7	Very low	28.2	Very low	161 Å²	161	146.9 Å²	146.9	86%	0.861	77%	0.769	S	S	*	*			trans	-71.6	147.6	179	-49	-89.5	0	0	0	111.5
468	K	31.6	Very low	28.3	Very low	190 Å²	190	146.4 Å²	146.4	83%	0.826	77%	0.77	S	S	*	*			trans	-156	118.5	148.9	-121.3	169.3	-173.6	177.4	0	111	F470	K468-F470 PolarHBondContact O-N 3.03Å
469	E	26.9	Very low	27.9	Very low	187 Å²	187	143.1 Å²	143.1	87%	0.874	76%	0.76	S	S	*	*			trans	-65.9	126.3	169.5	-61.1	169.4	115.7	0	0	109.1
470	F	30.1	Very low	27.9	Very low	181 Å²	181	143.9 Å²	143.9	79%	0.794	76%	0.764	S	S	*	*			trans	-134.2	101.3	154.9	-97.5	-84.3	0	0	0	107.8	K468 E472	K468-F470 PolarHBondContact O-N 3.03Å; F470-E472 PolarHBondContact O-N 2.99Å
471	S	26.6	Very low	27.8	Very low	115 Å²	115	146 Å²	146	80%	0.804	77%	0.766	S	S	*	*			trans	-82.1	106.3	173.7	55.1	0	0	0	0	109.4
472	E	31.3	Very low	27.7	Very low	175 Å²	175	142 Å²	142	82%	0.818	76%	0.761	S	S	*	*			trans	-138.6	131.9	169.3	-132.3	156.3	-150	0	0	111	F470 D474	F470-E472 PolarHBondContact O-N 2.99Å; E472-D474 PolarHBondContact O-N 2.69Å; E472-D474 VanDerWaalsContact O-N 3.13Å
473	N	25.9	Very low	27.6	Very low	171 Å²	171	143.5 Å²	143.5	91%	0.914	77%	0.772	S	S	*	*			trans	-87.4	75.8	-169.6	-69.3	-74.7	0	0	0	110.5
474	D	28	Very low	27.8	Very low	145 Å²	145	147.1 Å²	147.1	78%	0.775	78%	0.775	S	S	*	*			trans	-94	115.4	178.8	-135.3	-24.2	0	0	0	113.2	E472	E472-D474 PolarHBondContact O-N 2.69Å; E472-D474 VanDerWaalsContact O-N 3.13Å
475	S	25.7	Very low	27.5	Very low	70 Å²	70	145.6 Å²	145.6	49%	0.49	78%	0.778	S	S	.	*			trans	-75.7	131.4	178.7	59.3	0	0	0	0	110.6	N477	S475-N477 PolarHBondContact O-N 3.14Å; S475-N477 PolarHBondContact OG-ND2 3.13Å
476	F	27.5	Very low	27.8	Very low	202 Å²	202	148.9 Å²	148.9	89%	0.886	78%	0.775	S	S	*	*			trans	-73.6	61	166.1	-88	-86.7	0	0	0	111.8	T478	F476-T478 PolarHBondContact O-N 3.29Å
477	N	25.8	Very low	27.7	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	77%	0.771	S	S	*	*			trans	-76.3	69.5	169.5	-91.6	-41.8	0	0	0	109.8	S475 S479	S475-N477 PolarHBondContact O-N 3.14Å; S475-N477 PolarHBondContact OG-ND2 3.13Å; N477-S479 PolarHBondContact O-N 3.34Å
478	T	26.5	Very low	27.8	Very low	115 Å²	115	148 Å²	148	71%	0.706	77%	0.773	S	S	*	*			trans	-69.9	85.1	167.4	50.7	0	0	0	0	109.4	F476 I480	F476-T478 PolarHBondContact O-N 3.29Å; T478-I480 PolarHBondContact O-N 2.89Å; T478-I480 VanDerWaalsContact O-N 3.07Å
479	S	23.3	Very low	28	Very low	85 Å²	85	141.4 Å²	141.4	59%	0.594	76%	0.758	S	S	*	*			trans	-64.8	108.7	-178.6	66.4	0	0	0	0	110.6	N477 K481	N477-S479 PolarHBondContact O-N 3.34Å; S479-K481 PolarHBondContact O-N 3.19Å
480	I	26.5	Very low	28.6	Very low	145 Å²	145	135.8 Å²	135.8	74%	0.744	74%	0.74	S	S	*	*			trans	-74.9	78.5	168.3	-56.6	-177.9	0	0	0	107.9	T478 N482	T478-I480 PolarHBondContact O-N 2.89Å; T478-I480 VanDerWaalsContact O-N 3.07Å; I480-N482 HydrophobicContact CG2-CB 4.27Å; I480-N482 PolarHBondContact O-N 2.85Å
481	K	26.5	Very low	29.1	Very low	187 Å²	187	131.7 Å²	131.7	81%	0.813	73%	0.726	S	S	*	*			trans	-70.4	73.4	168.3	-76.8	-175.2	175.6	178.6	0	109.8	S479	S479-K481 PolarHBondContact O-N 3.19Å
482	N	26.7	Very low	29.9	Very low	143 Å²	143	126.5 Å²	126.5	77%	0.765	69%	0.689	S	S	*	*			trans	-109.5	116.1	164.2	-82.3	-34.6	0	0	0	108.8	I480	I480-N482 HydrophobicContact CG2-CB 4.27Å; I480-N482 PolarHBondContact O-N 2.85Å
483	S	25.1	Very low	30.7	Very low	113 Å²	113	119.7 Å²	119.7	79%	0.79	66%	0.661	S	S	*	*			trans	-86	127.4	-167.8	42.3	0	0	0	0	112.9
484	K	29.6	Very low	32	Very low	178 Å²	178	117.7 Å²	117.7	77%	0.774	64%	0.644	S	S	*	*				-168.7	129.6	126.4	-100.8	158.6	-174.9	-176.4	0	109.4
485	T	27.4	Very low	33.2	Very low	142 Å²	142	111.8 Å²	111.8	87%	0.871	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-70.6	132	178.7	41.5	0	0	0	0	110.7
486	W	31.9	Very low	34.2	Very low	172 Å²	172	108.6 Å²	108.6	65%	0.652	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-103.9	156.6	171.1	-72.8	89.1	0	0	0	110.3	T488 L531	W486-T488 PolarHBondContact O-N 2.95Å; W486-L531 HydrophobicContact CH2-CD2 3.55Å; W486-L531 HydrophobicContact CH2-CG 3.98Å; W486-L531 HydrophobicContact CZ2-CD2 3.49Å; W486-L531 VanDerWaalsContact CZ2-CD2 3.49Å; W486-L531 HydrophobicContact CZ2-CG 4.38Å
487	P	30.8	Very low	35.3	Very low	110 Å²	110	100 Å²	100	71%	0.714	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-58.4	133.9	-173.9	-25.9	35.6	0	0	0	113.2	G489	P487-G489 PolarHBondContact O-N 3.27Å
488	T	29.3	Very low	36.8	Very low	147 Å²	147	96 Å²	96	90%	0.902	54%	0.537	S	S	*	.			trans	-74.7	93	179.4	38	0	0	0	0	111.3	W486	W486-T488 PolarHBondContact O-N 2.95Å
489	G	36.1	Very low	38.1	Very low	51 Å²	51	91.6 Å²	91.6	53%	0.526	51%	0.509	S	S	.	.	S	Bend	trans	-152	165	168.6	0	0	0	0	0	110.3	P487 L491	P487-G489 PolarHBondContact O-N 3.27Å; G489-L491 VanDerWaalsContact C-N 3.32Å; G489-L491 PolarHBondContact O-N 2.99Å
490	S	39.4	Very low	39.4	Very low	69 Å²	69	87.9 Å²	87.9	48%	0.483	48%	0.483	S	S	.	.			trans	-70.1	81.2	-173.6	-175.7	0	0	0	0	113.1	T492 S493 K494	S490-T492 VanDerWaalsContact C-N 3.29Å; S490-T492 PolarHBondContact O-N 3.35Å; S490-S493 WeakPolarHBondContact CB-OG 3.36Å; S490-S493 PolarHBondContact O-OG 3.32Å; S490-S493 PolarHBondContact OG-OG 2.85Å; S490-K494 WeakPolarHBondContact O-CB 3.44Å; S490-K494 PolarHBondContact O-N 3.47Å
491	L	41.7	Very low	40.7	Very low	95 Å²	95	84.9 Å²	84.9	50%	0.497	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-30.4	-178.6	-137.9	80.4	0	0	0	112.4	G489 V495 Y917	G489-L491 VanDerWaalsContact C-N 3.32Å; G489-L491 PolarHBondContact O-N 2.99Å; L491-V495 WeakPolarHBondContact O-CB 3.49Å; L491-V495 WeakPolarHBondContact O-CG2 3.19Å; L491-V495 PolarHBondContact O-N 3.31Å; L491-Y917 HydrophobicContact CB-CE2 4.28Å; L491-Y917 HydrophobicContact CD2-CE2 4.13Å; L491-Y917 HydrophobicContact CG-CE2 4.49Å
492	T	43.1	Very low	42.1	Very low	6 Å²	6	76.5 Å²	76.5	4%	0.037	44%	0.438	C	S	.	.	H	α-helix	trans	-66.5	-53	179	40.2	0	0	0	0	112.1	S490 K494 V495 A496 P912 T916 Y917	S490-T492 VanDerWaalsContact C-N 3.29Å; S490-T492 PolarHBondContact O-N 3.35Å; T492-K494 VanDerWaalsContact C-N 3.33Å; T492-K494 PolarHBondContact O-N 3.28Å; T492-V495 PolarHBondContact O-N 2.83Å; T492-A496 WeakPolarHBondContact O-CB 3.35Å; T492-A496 PolarHBondContact O-N 2.98Å; T492-P912 HydrophobicContact CG2-CB 4.42Å; T492-T916 HydrophobicContact CG2-CG2 3.96Å; T492-Y917 HydrophobicContact CG2-CD2 3.76Å; T492-Y917 HydrophobicContact CG2-CE2 4.44Å
493	S	48.4	Very low	43.5	Very low	33 Å²	33	70.6 Å²	70.6	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-66.3	-36.6	177.4	61.7	0	0	0	0	111.7	S490 G497	S490-S493 WeakPolarHBondContact CB-OG 3.36Å; S490-S493 PolarHBondContact O-OG 3.32Å; S490-S493 PolarHBondContact OG-OG 2.85Å; S493-G497 PolarHBondContact O-N 2.83Å
494	K	53.5	Low	45.3	Very low	128 Å²	128	69.2 Å²	69.2	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-62.8	-43.9	175.8	-172.7	163.3	-175.5	165.3	0	112.4	S490 T492 G497 E498	S490-K494 WeakPolarHBondContact O-CB 3.44Å; S490-K494 PolarHBondContact O-N 3.47Å; T492-K494 VanDerWaalsContact C-N 3.33Å; T492-K494 PolarHBondContact O-N 3.28Å; K494-G497 PolarHBondContact O-N 3.38Å; K494-E498 WeakPolarHBondContact CE-OE1 3.41Å; K494-E498 HydrophobicContact CG-CG 4.46Å; K494-E498 WeakPolarHBondContact O-CB 3.38Å; K494-E498 WeakPolarHBondContact O-CG 3.22Å; K494-E498 PolarHBondContact O-N 3.12Å
495	V	52.3	Low	46	Very low	22 Å²	22	61.3 Å²	61.3	13%	0.133	35%	0.352	C	S	.	.	H	α-helix	trans	-77.6	-33.4	179.5	168.6	0	0	0	0	112.7	L491 T492 G497 I499 F526 Y917	L491-V495 WeakPolarHBondContact O-CB 3.49Å; L491-V495 WeakPolarHBondContact O-CG2 3.19Å; L491-V495 PolarHBondContact O-N 3.31Å; T492-V495 PolarHBondContact O-N 2.83Å; V495-G497 VanDerWaalsContact C-N 3.34Å; V495-I499 HydrophobicContact CG1-CD1 3.73Å; V495-I499 HydrophobicContact CG1-CG1 4.34Å; V495-I499 WeakPolarHBondContact O-CB 3.34Å; V495-I499 WeakPolarHBondContact O-CD1 3.43Å; V495-I499 WeakPolarHBondContact O-CG1 3.45Å; V495-I499 PolarHBondContact O-N 2.94Å; V495-F526 HydrophobicContact CG1-CZ 4.43Å; V495-Y917 WeakPolarHBondContact CG2-OH 3.28Å
496	A	46.8	Very low	47.2	Very low	2 Å²	2	57.2 Å²	57.2	2%	0.017	33%	0.325	C	S	.	.	H	α-helix	trans	-59.7	-45.4	168.3	0	0	0	0	0	111.2	T492 I499 A500 I920	T492-A496 WeakPolarHBondContact O-CB 3.35Å; T492-A496 PolarHBondContact O-N 2.98Å; A496-I499 PolarHBondContact O-N 2.98Å; A496-A500 VanDerWaalsContact O-CB 3.31Å; A496-A500 WeakPolarHBondContact O-CB 3.1Å; A496-A500 PolarHBondContact O-N 3.28Å; A496-I920 HydrophobicContact CB-CD1 4.28Å
497	G	51.1	Low	48.3	Very low	23 Å²	23	49.9 Å²	49.9	24%	0.237	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-48.8	175	0	0	0	0	0	113.8	S493 K494 V495 I499 A500 C501	S493-G497 PolarHBondContact O-N 2.83Å; K494-G497 PolarHBondContact O-N 3.38Å; V495-G497 VanDerWaalsContact C-N 3.34Å; G497-I499 VanDerWaalsContact C-N 3.28Å; G497-I499 PolarHBondContact O-N 2.87Å; G497-A500 PolarHBondContact O-N 2.7Å; G497-C501 WeakPolarHBondContact O-CB 3.44Å; G497-C501 PolarHBondContact O-N 3.22Å; G497-C501 PolarHBondContact O-SG 3.2Å; G497-C501 VanDerWaalsContact O-SG 3.34Å
498	E	56.2	Low	49.1	Very low	51 Å²	51	49.6 Å²	49.6	24%	0.238	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-37.6	177	-73.7	179.9	-168.3	0	0	111.4	K494 L502 F526 R529	K494-E498 WeakPolarHBondContact CE-OE1 3.41Å; K494-E498 HydrophobicContact CG-CG 4.46Å; K494-E498 WeakPolarHBondContact O-CB 3.38Å; K494-E498 WeakPolarHBondContact O-CG 3.22Å; K494-E498 PolarHBondContact O-N 3.12Å; E498-L502 WeakPolarHBondContact O-CG 3.42Å; E498-L502 PolarHBondContact O-N 3.06Å; E498-L502 VanDerWaalsContact O-N 3.12Å; E498-F526 HydrophobicContact CB-CE2 3.87Å; E498-F526 WeakPolarHBondContact OE2-CE2 3.45Å; E498-R529 IonicContact OE1-NH1 2.7Å; E498-R529 IonicContact OE2-NH1 3.26Å; E498-R529 PolarHBondContact OE2-NH1 3Å
499	I	54.9	Low	50.1	Low	21 Å²	21	44.2 Å²	44.2	11%	0.108	25%	0.254	C	S	.	.	H	α-helix	trans	-70.7	-42.5	173.9	-67.5	168.7	0	0	0	111.7	V495 A496 G497 C501 L502 Y503 F526 L860 I920	V495-I499 HydrophobicContact CG1-CD1 3.73Å; V495-I499 HydrophobicContact CG1-CG1 4.34Å; V495-I499 WeakPolarHBondContact O-CB 3.34Å; V495-I499 WeakPolarHBondContact O-CD1 3.43Å; V495-I499 WeakPolarHBondContact O-CG1 3.45Å; V495-I499 PolarHBondContact O-N 2.94Å; A496-I499 PolarHBondContact O-N 2.98Å; G497-I499 VanDerWaalsContact C-N 3.28Å; G497-I499 PolarHBondContact O-N 2.87Å; I499-C501 VanDerWaalsContact C-N 3.35Å; I499-C501 PolarHBondContact O-N 3.47Å; I499-L502 WeakPolarHBondContact O-CB 3.49Å; I499-L502 PolarHBondContact O-N 3.01Å; I499-Y503 HydrophobicContact CG2-CD2 3.7Å; I499-Y503 HydrophobicContact CG2-CE2 3.31Å; I499-Y503 WeakPolarHBondContact O-CD2 3.37Å; I499-Y503 PolarHBondContact O-N 3Å; I499-F526 HydrophobicContact CG1-CZ 4.48Å; I499-L860 HydrophobicContact CB-CD1 4.24Å; I499-L860 HydrophobicContact CG2-CD1 3.61Å; I499-I920 HydrophobicContact CD1-CG2 4.01Å
500	A	50.4	Low	50.8	Low	7 Å²	7	43.7 Å²	43.7	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-39.7	177.4	0	0	0	0	0	111.7	A496 G497 Y503 R504	A496-A500 VanDerWaalsContact O-CB 3.31Å; A496-A500 WeakPolarHBondContact O-CB 3.1Å; A496-A500 PolarHBondContact O-N 3.28Å; G497-A500 PolarHBondContact O-N 2.7Å; A500-Y503 CarbonylContact O-C 3.46Å; A500-Y503 PolarHBondContact O-N 2.79Å; A500-R504 WeakPolarHBondContact O-CG 3.4Å; A500-R504 PolarHBondContact O-N 2.99Å
501	C	52.6	Low	50.7	Low	83 Å²	83	42.7 Å²	42.7	56%	0.561	24%	0.239	S	C	*	.	H	α-helix	trans	-63.8	-42.8	173.3	-70.5	0	0	0	0	112.3	G497 I499 Y503 R504 G505	G497-C501 WeakPolarHBondContact O-CB 3.44Å; G497-C501 PolarHBondContact O-N 3.22Å; G497-C501 PolarHBondContact O-SG 3.2Å; G497-C501 VanDerWaalsContact O-SG 3.34Å; I499-C501 VanDerWaalsContact C-N 3.35Å; I499-C501 PolarHBondContact O-N 3.47Å; C501-Y503 VanDerWaalsContact C-N 3.27Å; C501-Y503 PolarHBondContact O-N 3.04Å; C501-R504 PolarHBondContact O-N 3.08Å; C501-G505 PolarHBondContact O-N 2.98Å
502	L	56.9	Low	50.5	Low	11 Å²	11	40.3 Å²	40.3	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-57.5	-40.2	171.4	-83.5	170.9	0	0	0	112	E498 I499 L506 T522 W523 F526	E498-L502 WeakPolarHBondContact O-CG 3.42Å; E498-L502 PolarHBondContact O-N 3.06Å; E498-L502 VanDerWaalsContact O-N 3.12Å; I499-L502 WeakPolarHBondContact O-CB 3.49Å; I499-L502 PolarHBondContact O-N 3.01Å; L502-L506 WeakPolarHBondContact O-CB 3.46Å; L502-L506 VanDerWaalsContact O-CG 3.31Å; L502-L506 WeakPolarHBondContact O-CG 3.45Å; L502-L506 PolarHBondContact O-N 2.88Å; L502-T522 HydrophobicContact CD2-CG2 3.56Å; L502-T522 HydrophobicContact CG-CG2 4.02Å; L502-W523 HydrophobicContact CD1-CE3 4.28Å; L502-W523 HydrophobicContact CD2-CB 4.45Å; L502-W523 HydrophobicContact CD2-CE3 4.28Å; L502-F526 HydrophobicContact CD1-CB 4.49Å; L502-F526 HydrophobicContact CD1-CD2 4.03Å; L502-F526 HydrophobicContact CD1-CG 4.28Å
503	Y	56.4	Low	50.1	Low	19 Å²	19	46.9 Å²	46.9	8%	0.075	27%	0.266	C	S	.	.	H	α-helix	trans	-74.2	-34.3	176.9	-67.6	-38.8	0	0	0	113.8	I499 A500 C501 L506 I507 L853 H856 I857 L860	I499-Y503 HydrophobicContact CG2-CD2 3.7Å; I499-Y503 HydrophobicContact CG2-CE2 3.31Å; I499-Y503 WeakPolarHBondContact O-CD2 3.37Å; I499-Y503 PolarHBondContact O-N 3Å; A500-Y503 CarbonylContact O-C 3.46Å; A500-Y503 PolarHBondContact O-N 2.79Å; C501-Y503 VanDerWaalsContact C-N 3.27Å; C501-Y503 PolarHBondContact O-N 3.04Å; Y503-L506 HydrophobicContact CD1-CD1 4.04Å; Y503-L506 HydrophobicContact CE1-CD1 4.48Å; Y503-L506 PolarHBondContact O-N 3.23Å; Y503-I507 WeakPolarHBondContact O-CB 3.32Å; Y503-I507 WeakPolarHBondContact O-CD1 3.16Å; Y503-I507 VanDerWaalsContact O-CG1 3.22Å; Y503-I507 WeakPolarHBondContact O-CG1 3.26Å; Y503-I507 PolarHBondContact O-N 2.76Å; Y503-L853 HydrophobicContact CD1-CD2 3.45Å; Y503-L853 VanDerWaalsContact CD1-CD2 3.45Å; Y503-L853 HydrophobicContact CE1-CD2 3.72Å; Y503-L853 HydrophobicContact CG-CD2 3.98Å; Y503-H856 AromaticContact CD2-ND1 3.85Å; Y503-H856 AromaticContact CE2-CE1 3.8Å; Y503-H856 AromaticContact CE2-ND1 3.2Å; Y503-H856 WeakPolarHBondContact CE2-ND1 3.34Å; Y503-I857 HydrophobicContact CD2-CG1 4.5Å; Y503-L860 HydrophobicContact CD2-CD1 4.3Å; Y503-L860 HydrophobicContact CE2-CD1 4.35Å
504	R	62.1	Low	49.5	Very low	83 Å²	83	53.2 Å²	53.2	31%	0.313	29%	0.289	S	S	.	.	H	α-helix	trans	-61.3	-48.5	170.6	-70.3	-176.9	-145.4	-96.5	-6.3	111.1	A500 C501 L506 I507 E508 I857 E861	A500-R504 WeakPolarHBondContact O-CG 3.4Å; A500-R504 PolarHBondContact O-N 2.99Å; C501-R504 PolarHBondContact O-N 3.08Å; R504-L506 VanDerWaalsContact C-N 3.3Å; R504-L506 PolarHBondContact O-N 3.09Å; R504-I507 CarbonylContact O-C 3.58Å; R504-I507 WeakPolarHBondContact O-CA 3.23Å; R504-I507 WeakPolarHBondContact O-CB 3.24Å; R504-I507 PolarHBondContact O-N 3.47Å; R504-E508 WeakPolarHBondContact O-CG 3.24Å; R504-E508 PolarHBondContact O-N 3.38Å; R504-I857 HydrophobicContact CG-CD1 4.03Å; R504-E861 IonicContact CZ-OE1 3.59Å; R504-E861 IonicContact NH1-OE1 3.21Å; R504-E861 IonicContact NH2-OE1 2.93Å; R504-E861 PolarHBondContact NH2-OE1 3.21Å
505	G	45.8	Very low	48.7	Very low	12 Å²	12	54.8 Å²	54.8	12%	0.124	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-35.3	174.4	0	0	0	0	0	113.6	C501 E508 T509	C501-G505 PolarHBondContact O-N 2.98Å; G505-E508 PolarHBondContact O-N 2.87Å; G505-T509 PolarHBondContact O-N 3.28Å; G505-T509 PolarHBondContact O-OG1 3.4Å
506	L	51.4	Low	48	Very low	57 Å²	57	56.3 Å²	56.3	30%	0.298	31%	0.309	S	S	.	.	H	α-helix	trans	-69.4	-32.4	171.4	-75.5	168.7	0	0	0	112.8	L502 Y503 R504 T509 I510 T519 L853	L502-L506 WeakPolarHBondContact O-CB 3.46Å; L502-L506 VanDerWaalsContact O-CG 3.31Å; L502-L506 WeakPolarHBondContact O-CG 3.45Å; L502-L506 PolarHBondContact O-N 2.88Å; Y503-L506 HydrophobicContact CD1-CD1 4.04Å; Y503-L506 HydrophobicContact CE1-CD1 4.48Å; Y503-L506 PolarHBondContact O-N 3.23Å; R504-L506 VanDerWaalsContact C-N 3.3Å; R504-L506 PolarHBondContact O-N 3.09Å; L506-T509 WeakPolarHBondContact CA-OG1 3.36Å; L506-T509 PolarHBondContact O-OG1 2.97Å; L506-I510 WeakPolarHBondContact O-CB 3.42Å; L506-I510 WeakPolarHBondContact O-CD1 3.2Å; L506-I510 WeakPolarHBondContact O-CG1 3.47Å; L506-I510 PolarHBondContact O-N 3.26Å; L506-T519 HydrophobicContact CD2-CG2 4.28Å; L506-T519 HydrophobicContact CG-CG2 4.08Å; L506-L853 HydrophobicContact CB-CD1 4.28Å
507	I	54.8	Low	47.7	Very low	17 Å²	17	62 Å²	62	9%	0.087	34%	0.336	C	S	.	.	H	α-helix	trans	-71.5	-35.5	172.5	-70.5	158.5	0	0	0	111.3	Y503 R504 I510 G511 R850 L853 N854 I857	Y503-I507 WeakPolarHBondContact O-CB 3.32Å; Y503-I507 WeakPolarHBondContact O-CD1 3.16Å; Y503-I507 VanDerWaalsContact O-CG1 3.22Å; Y503-I507 WeakPolarHBondContact O-CG1 3.26Å; Y503-I507 PolarHBondContact O-N 2.76Å; R504-I507 CarbonylContact O-C 3.58Å; R504-I507 WeakPolarHBondContact O-CA 3.23Å; R504-I507 WeakPolarHBondContact O-CB 3.24Å; R504-I507 PolarHBondContact O-N 3.47Å; I507-I510 CarbonylContact O-C 3.56Å; I507-I510 PolarHBondContact O-N 3.34Å; I507-G511 PolarHBondContact O-N 3.12Å; I507-R850 HydrophobicContact CG1-CG 4.35Å; I507-R850 HydrophobicContact CG2-CG 4.03Å; I507-L853 HydrophobicContact CD1-CB 3.84Å; I507-L853 HydrophobicContact CG1-CB 3.86Å; I507-L853 HydrophobicContact CG1-CD1 4Å; I507-N854 VanDerWaalsContact CD1-OD1 3.31Å; I507-N854 WeakPolarHBondContact CD1-OD1 3.48Å; I507-I857 HydrophobicContact CD1-CD1 3.44Å; I507-I857 VanDerWaalsContact CD1-CD1 3.44Å
508	E	47.4	Very low	47.2	Very low	105 Å²	105	64 Å²	64	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-72.4	-40.2	178.6	-72.9	158.7	-154.8	0	0	112.2	R504 G505 I510 G511 S512 I516	R504-E508 WeakPolarHBondContact O-CG 3.24Å; R504-E508 PolarHBondContact O-N 3.38Å; G505-E508 PolarHBondContact O-N 2.87Å; E508-I510 VanDerWaalsContact C-N 3.32Å; E508-G511 CarbonylContact O-C 3.57Å; E508-G511 WeakPolarHBondContact O-CA 3.4Å; E508-G511 PolarHBondContact O-N 3.44Å; E508-S512 PolarHBondContact O-N 2.98Å; E508-S512 PolarHBondContact O-OG 2.68Å; E508-I516 HydrophobicContact CB-CD1 4.33Å
509	T	50.8	Low	46.2	Very low	34 Å²	34	62.3 Å²	62.3	21%	0.209	34%	0.339	C	S	.	.	H	α-helix	trans	-71.2	-24.5	168	49	0	0	0	0	113	G505 L506 G511 I516	G505-T509 PolarHBondContact O-N 3.28Å; G505-T509 PolarHBondContact O-OG1 3.4Å; L506-T509 WeakPolarHBondContact CA-OG1 3.36Å; L506-T509 PolarHBondContact O-OG1 2.97Å; T509-G511 VanDerWaalsContact C-N 3.31Å; T509-I516 HydrophobicContact CG2-CB 3.54Å; T509-I516 HydrophobicContact CG2-CD1 3.92Å; T509-I516 HydrophobicContact CG2-CG1 3.67Å
510	I	50.9	Low	45.4	Very low	40 Å²	40	65 Å²	65	21%	0.205	36%	0.36	C	S	.	.	H	α-helix	trans	-76.6	-20	166.2	-75.8	169.3	0	0	0	111.4	L506 I507 E508 R846 V849 R850 L853	L506-I510 WeakPolarHBondContact O-CB 3.42Å; L506-I510 WeakPolarHBondContact O-CD1 3.2Å; L506-I510 WeakPolarHBondContact O-CG1 3.47Å; L506-I510 PolarHBondContact O-N 3.26Å; I507-I510 CarbonylContact O-C 3.56Å; I507-I510 PolarHBondContact O-N 3.34Å; E508-I510 VanDerWaalsContact C-N 3.32Å; I510-R846 HydrophobicContact CG2-CG 3.8Å; I510-R846 VanDerWaalsContact O-CZ 3.29Å; I510-R846 PolarHBondContact O-NE 2.92Å; I510-R846 PolarHBondContact O-NH2 3.36Å; I510-V849 HydrophobicContact CD1-CG1 3.94Å; I510-R850 HydrophobicContact CG2-CB 4.16Å; I510-L853 HydrophobicContact CD1-CD1 4.07Å
511	G	38.2	Very low	44.8	Very low	48 Å²	48	69.5 Å²	69.5	50%	0.495	38%	0.38	S	S	.	.	H	α-helix	trans	-99.4	-15.1	-178.4	0	0	0	0	0	115.7	I507 E508 T509	I507-G511 PolarHBondContact O-N 3.12Å; E508-G511 CarbonylContact O-C 3.57Å; E508-G511 WeakPolarHBondContact O-CA 3.4Å; E508-G511 PolarHBondContact O-N 3.44Å; T509-G511 VanDerWaalsContact C-N 3.31Å
512	S	35.7	Very low	44	Very low	44 Å²	44	68.7 Å²	68.7	31%	0.308	37%	0.372	S	S	.	.	S	Bend	trans	-136.1	145.9	-179.8	64.8	0	0	0	0	110.1	E508 K514	E508-S512 PolarHBondContact O-N 2.98Å; E508-S512 PolarHBondContact O-OG 2.68Å; S512-K514 PolarHBondContact O-N 3.03Å; S512-K514 VanDerWaalsContact O-N 3.12Å
513	D	35.6	Very low	43.2	Very low	145 Å²	145	74.1 Å²	74.1	78%	0.775	39%	0.392	S	S	*	.	S	Bend	trans	-85.1	20.4	-177.6	-46.8	-63.2	0	0	0	112.2	R846	D513-R846 IonicContact OD1-CZ 2.79Å; D513-R846 IonicContact OD1-NH1 2.99Å; D513-R846 PolarHBondContact OD1-NH1 3.45Å; D513-R846 IonicContact OD1-NH2 3.83Å; D513-R846 PolarHBondContact OD1-NH2 2.96Å
514	K	35.2	Very low	42.3	Very low	165 Å²	165	75.7 Å²	75.7	72%	0.717	41%	0.406	S	S	*	.	S	Bend	trans	-91	121	168	-71.6	-168.3	174.5	-170.6	0	109.5	S512 I516	S512-K514 PolarHBondContact O-N 3.03Å; S512-K514 VanDerWaalsContact O-N 3.12Å; K514-I516 VanDerWaalsContact C-N 3.33Å; K514-I516 PolarHBondContact O-N 3.48Å
515	L	37	Very low	41.1	Very low	162 Å²	162	77.8 Å²	77.8	85%	0.848	42%	0.419	S	S	*	.			trans	-74.8	86.2	173.3	-141.3	169	0	0	0	108.3	E517	L515-E517 PolarHBondContact O-N 3.34Å
516	I	38.6	Very low	40.5	Very low	53 Å²	53	80.9 Å²	80.9	27%	0.272	43%	0.429	S	S	.	.			trans	-67.2	106.4	-175.3	-57.7	174.5	0	0	0	109.4	E508 T509 K514 S518 T519	E508-I516 HydrophobicContact CB-CD1 4.33Å; T509-I516 HydrophobicContact CG2-CB 3.54Å; T509-I516 HydrophobicContact CG2-CD1 3.92Å; T509-I516 HydrophobicContact CG2-CG1 3.67Å; K514-I516 VanDerWaalsContact C-N 3.33Å; K514-I516 PolarHBondContact O-N 3.48Å; I516-S518 WeakPolarHBondContact CG2-OG 3.33Å; I516-S518 PolarHBondContact O-N 2.87Å; I516-T519 PolarHBondContact O-N 2.84Å; I516-T519 VanDerWaalsContact O-N 3.11Å; I516-T519 PolarHBondContact O-OG1 2.84Å
517	E	40.2	Very low	39.9	Very low	122 Å²	122	81.3 Å²	81.3	57%	0.57	43%	0.434	S	S	*	.	H	α-helix	trans	-59.4	-34.6	-177.5	-156.6	-160	148.2	0	0	112.2	L515 T519 S520 Q521	L515-E517 PolarHBondContact O-N 3.34Å; E517-T519 PolarHBondContact O-N 3.26Å; E517-T519 VanDerWaalsContact O-N 3.16Å; E517-S520 CarbonylContact O-C 3.52Å; E517-S520 WeakPolarHBondContact O-CA 3.19Å; E517-S520 VanDerWaalsContact O-CB 3.27Å; E517-S520 WeakPolarHBondContact O-CB 3.28Å; E517-S520 PolarHBondContact O-N 3.45Å; E517-Q521 HydrophobicContact CG-CG 4.4Å; E517-Q521 WeakPolarHBondContact O-CG 3.4Å; E517-Q521 PolarHBondContact O-N 2.86Å; E517-Q521 PolarHBondContact OE1-NE2 3.07Å
518	S	39.4	Very low	38.9	Very low	64 Å²	64	87.1 Å²	87.1	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-59.1	-29.1	177.8	75.5	0	0	0	0	112.9	I516 Q521 T522	I516-S518 WeakPolarHBondContact CG2-OG 3.33Å; I516-S518 PolarHBondContact O-N 2.87Å; S518-Q521 PolarHBondContact O-N 3.13Å; S518-T522 VanDerWaalsContact O-CB 3.23Å; S518-T522 WeakPolarHBondContact O-CB 3.39Å; S518-T522 PolarHBondContact O-N 3.22Å; S518-T522 PolarHBondContact O-OG1 3.37Å
519	T	36.9	Very low	38	Very low	17 Å²	17	89.1 Å²	89.1	10%	0.104	46%	0.464	C	S	.	.	H	α-helix	trans	-66.5	-39.3	172.5	-8.4	0	0	0	0	111.6	L506 I516 E517 W523	L506-T519 HydrophobicContact CD2-CG2 4.28Å; L506-T519 HydrophobicContact CG-CG2 4.08Å; I516-T519 PolarHBondContact O-N 2.84Å; I516-T519 VanDerWaalsContact O-N 3.11Å; I516-T519 PolarHBondContact O-OG1 2.84Å; E517-T519 PolarHBondContact O-N 3.26Å; E517-T519 VanDerWaalsContact O-N 3.16Å; T519-W523 VanDerWaalsContact O-CB 3.28Å; T519-W523 WeakPolarHBondContact O-CB 3.19Å; T519-W523 PolarHBondContact O-N 3Å
520	S	38	Very low	36.9	Very low	78 Å²	78	96 Å²	96	55%	0.545	49%	0.491	S	S	.	.	H	α-helix	trans	-68.4	-46.7	174.7	-169.6	0	0	0	0	111.1	E517 T522 W523 S524	E517-S520 CarbonylContact O-C 3.52Å; E517-S520 WeakPolarHBondContact O-CA 3.19Å; E517-S520 VanDerWaalsContact O-CB 3.27Å; E517-S520 WeakPolarHBondContact O-CB 3.28Å; E517-S520 PolarHBondContact O-N 3.45Å; S520-T522 PolarHBondContact O-N 3.31Å; S520-W523 PolarHBondContact O-N 3.02Å; S520-S524 VanDerWaalsContact O-CB 3.23Å; S520-S524 WeakPolarHBondContact O-CB 3.41Å; S520-S524 PolarHBondContact O-N 3.43Å
521	Q	36.7	Very low	35.8	Very low	100 Å²	100	100.2 Å²	100.2	47%	0.467	51%	0.513	S	S	.	.	H	α-helix	trans	-62.6	-39.5	176.4	-64.6	177.4	-0.8	0	0	112.1	E517 S518 S524 H525	E517-Q521 HydrophobicContact CG-CG 4.4Å; E517-Q521 WeakPolarHBondContact O-CG 3.4Å; E517-Q521 PolarHBondContact O-N 2.86Å; E517-Q521 PolarHBondContact OE1-NE2 3.07Å; S518-Q521 PolarHBondContact O-N 3.13Å; Q521-S524 WeakPolarHBondContact O-CB 3.1Å; Q521-S524 PolarHBondContact O-N 2.74Å; Q521-H525 WeakPolarHBondContact O-CB 3.46Å; Q521-H525 PolarHBondContact O-N 3.4Å
522	T	37.2	Very low	35.2	Very low	66 Å²	66	107.2 Å²	107.2	41%	0.405	53%	0.533	S	S	.	.	H	α-helix	trans	-70.5	-41.4	177.3	-51.3	0	0	0	0	111.4	L502 S518 S520 S524 H525 F526	L502-T522 HydrophobicContact CD2-CG2 3.56Å; L502-T522 HydrophobicContact CG-CG2 4.02Å; S518-T522 VanDerWaalsContact O-CB 3.23Å; S518-T522 WeakPolarHBondContact O-CB 3.39Å; S518-T522 PolarHBondContact O-N 3.22Å; S518-T522 PolarHBondContact O-OG1 3.37Å; S520-T522 PolarHBondContact O-N 3.31Å; T522-S524 VanDerWaalsContact C-N 3.33Å; T522-H525 WeakPolarHBondContact O-CB 3.19Å; T522-H525 PolarHBondContact O-N 2.82Å; T522-F526 PolarHBondContact O-N 3.04Å
523	W	38.4	Very low	34.8	Very low	125 Å²	125	109.2 Å²	109.2	47%	0.473	55%	0.547	S	S	.	.	H	α-helix	trans	-66.1	-36.2	173.9	-168.7	-84.8	0	0	0	112.1	L502 T519 S520 F526 T527	L502-W523 HydrophobicContact CD1-CE3 4.28Å; L502-W523 HydrophobicContact CD2-CB 4.45Å; L502-W523 HydrophobicContact CD2-CE3 4.28Å; T519-W523 VanDerWaalsContact O-CB 3.28Å; T519-W523 WeakPolarHBondContact O-CB 3.19Å; T519-W523 PolarHBondContact O-N 3Å; S520-W523 PolarHBondContact O-N 3.02Å; W523-F526 PolarHBondContact O-N 2.96Å; W523-T527 PolarHBondContact O-N 3.32Å; W523-T527 PolarHBondContact O-OG1 2.81Å
524	S	38.1	Very low	34.5	Very low	53 Å²	53	107.1 Å²	107.1	37%	0.371	54%	0.543	S	S	.	.	H	α-helix	trans	-61.1	-49.8	169.3	-175.5	0	0	0	0	110.2	S520 Q521 T522 F526 T527 H528	S520-S524 VanDerWaalsContact O-CB 3.23Å; S520-S524 WeakPolarHBondContact O-CB 3.41Å; S520-S524 PolarHBondContact O-N 3.43Å; Q521-S524 WeakPolarHBondContact O-CB 3.1Å; Q521-S524 PolarHBondContact O-N 2.74Å; T522-S524 VanDerWaalsContact C-N 3.33Å; S524-F526 VanDerWaalsContact C-N 3.26Å; S524-F526 PolarHBondContact O-N 2.79Å; S524-T527 PolarHBondContact O-N 2.99Å; S524-T527 VanDerWaalsContact O-N 3.14Å; S524-T527 PolarHBondContact O-OG1 3.41Å; S524-H528 WeakPolarHBondContact O-CA 3.36Å; S524-H528 WeakPolarHBondContact O-CB 3.34Å; S524-H528 PolarHBondContact O-CD2 3.45Å; S524-H528 PolarHBondContact O-N 3.19Å
525	H	36.1	Very low	34	Very low	126 Å²	126	105.9 Å²	105.9	58%	0.583	55%	0.55	S	S	*	*	H	α-helix	trans	-56.4	-37.8	174.9	-111.2	-74.1	0	0	0	113	Q521 T522 R529	Q521-H525 WeakPolarHBondContact O-CB 3.46Å; Q521-H525 PolarHBondContact O-N 3.4Å; T522-H525 WeakPolarHBondContact O-CB 3.19Å; T522-H525 PolarHBondContact O-N 2.82Å; H525-R529 WeakPolarHBondContact O-CB 3.31Å; H525-R529 WeakPolarHBondContact O-CG 3.1Å; H525-R529 PolarHBondContact O-N 3.02Å
526	F	34.6	Very low	33.7	Very low	77 Å²	77	105.5 Å²	105.5	34%	0.338	55%	0.547	S	S	.	.	H	α-helix	trans	-72.1	-37.2	177.9	-132.7	-87.2	0	0	0	113.2	V495 E498 I499 L502 T522 W523 S524	V495-F526 HydrophobicContact CG1-CZ 4.43Å; E498-F526 HydrophobicContact CB-CE2 3.87Å; E498-F526 WeakPolarHBondContact OE2-CE2 3.45Å; I499-F526 HydrophobicContact CG1-CZ 4.48Å; L502-F526 HydrophobicContact CD1-CB 4.49Å; L502-F526 HydrophobicContact CD1-CD2 4.03Å; L502-F526 HydrophobicContact CD1-CG 4.28Å; T522-F526 PolarHBondContact O-N 3.04Å; W523-F526 PolarHBondContact O-N 2.96Å; S524-F526 VanDerWaalsContact C-N 3.26Å; S524-F526 PolarHBondContact O-N 2.79Å
527	T	37.9	Very low	33.1	Very low	66 Å²	66	109.8 Å²	109.8	41%	0.405	57%	0.571	S	S	.	*	H	α-helix	trans	-88.3	-23.2	-179.2	53	0	0	0	0	113.9	W523 S524	W523-T527 PolarHBondContact O-N 3.32Å; W523-T527 PolarHBondContact O-OG1 2.81Å; S524-T527 PolarHBondContact O-N 2.99Å; S524-T527 VanDerWaalsContact O-N 3.14Å; S524-T527 PolarHBondContact O-OG1 3.41Å
528	H	33.1	Very low	32.4	Very low	139 Å²	139	111 Å²	111	64%	0.644	58%	0.581	S	S	*	*	H	α-helix	trans	-101.2	-2.5	177.5	-69.6	-102.6	0	0	0	113.8	S524 K530	S524-H528 WeakPolarHBondContact O-CA 3.36Å; S524-H528 WeakPolarHBondContact O-CB 3.34Å; S524-H528 PolarHBondContact O-CD2 3.45Å; S524-H528 PolarHBondContact O-N 3.19Å; H528-K530 PolarHBondContact O-N 2.83Å
529	R	28.6	Very low	31.8	Very low	147 Å²	147	114.2 Å²	114.2	56%	0.555	60%	0.598	S	S	*	*			trans	-64.4	68.6	158.9	-94.7	178.3	177.6	168.9	3.2	110.8	E498 H525	E498-R529 IonicContact OE1-NH1 2.7Å; E498-R529 IonicContact OE2-NH1 3.26Å; E498-R529 PolarHBondContact OE2-NH1 3Å; H525-R529 WeakPolarHBondContact O-CB 3.31Å; H525-R529 WeakPolarHBondContact O-CG 3.1Å; H525-R529 PolarHBondContact O-N 3.02Å
530	K	28.9	Very low	31.2	Very low	180 Å²	180	118.4 Å²	118.4	78%	0.783	63%	0.625	S	S	*	*			trans	-50.5	146	140	-78.3	-179.5	175.5	175.7	0	107.4	H528 Q532	H528-K530 PolarHBondContact O-N 2.83Å; K530-Q532 VanDerWaalsContact C-N 3.34Å; K530-Q532 PolarHBondContact O-N 2.94Å
531	L	27.9	Very low	30.6	Very low	127 Å²	127	120.1 Å²	120.1	67%	0.665	64%	0.637	S	S	*	*			trans	-59.9	97.6	167.8	-83.8	57.3	0	0	0	108.8	W486 S533	W486-L531 HydrophobicContact CH2-CD2 3.55Å; W486-L531 HydrophobicContact CH2-CG 3.98Å; W486-L531 HydrophobicContact CZ2-CD2 3.49Å; W486-L531 VanDerWaalsContact CZ2-CD2 3.49Å; W486-L531 HydrophobicContact CZ2-CG 4.38Å; L531-S533 PolarHBondContact O-N 2.91Å
532	Q	26	Very low	30	Very low	195 Å²	195	124.6 Å²	124.6	91%	0.911	66%	0.655	S	S	*	*			trans	-76.8	63.3	159	-75	-176.1	-30.2	0	0	108.2	K530 S534	K530-Q532 VanDerWaalsContact C-N 3.34Å; K530-Q532 PolarHBondContact O-N 2.94Å; Q532-S534 PolarHBondContact O-N 3.23Å
533	S	27.2	Very low	29.5	Very low	87 Å²	87	125.8 Å²	125.8	61%	0.608	66%	0.66	S	S	*	*			trans	-65	124.9	163.5	53.6	0	0	0	0	107.9	L531 T535	L531-S533 PolarHBondContact O-N 2.91Å; S533-T535 PolarHBondContact O-N 3.22Å
534	S	27.7	Very low	29	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	68%	0.68	S	S	*	*			trans	-53.4	127.5	-177	40.8	0	0	0	0	113	Q532 I536	Q532-S534 PolarHBondContact O-N 3.23Å; S534-I536 PolarHBondContact O-N 3.4Å
535	T	25.8	Very low	28.6	Very low	140 Å²	140	133.6 Å²	133.6	86%	0.859	69%	0.688	S	S	*	*	S	Bend	trans	14.1	73.9	149	-40.4	0	0	0	0	118	S533	S533-T535 PolarHBondContact O-N 3.22Å
536	I	30.8	Very low	28.1	Very low	154 Å²	154	131.9 Å²	131.9	79%	0.79	69%	0.691	S	S	*	*			trans	-133.3	132.1	150	-78.3	99.3	0	0	0	108.1	S534	S534-I536 PolarHBondContact O-N 3.4Å
537	N	26.1	Very low	27.7	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	71%	0.711	S	S	*	*			trans	-69.2	151.5	176.3	-68.5	-41.7	0	0	0	111.4
538	N	25.2	Very low	27.1	Very low	148 Å²	148	140.7 Å²	140.7	79%	0.791	73%	0.728	S	S	*	*			trans	99.3	104.8	174.3	-53.1	-33.7	0	0	0	117.4
539	V	26.4	Very low	26.7	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	73%	0.727	S	S	*	*			trans	71	133.8	144.7	-175.3	0	0	0	0	118.5
540	P	25.1	Very low	26.5	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	74%	0.737	S	S	*	*			cis	-123.7	-177.7	-34.3	35.3	-16.4	0	0	0	111.8	F542	P540-F542 PolarHBondContact O-N 3.39Å
541	S	24.3	Very low	26.3	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	74%	0.736	S	S	*	*			trans	-74.8	114.6	178.2	45.8	0	0	0	0	113.3	N543	S541-N543 PolarHBondContact O-N 2.85Å
542	F	24.3	Very low	26.3	Very low	194 Å²	194	141.4 Å²	141.4	85%	0.851	74%	0.737	S	S	*	*			trans	-73.2	91.6	177.8	-127.8	-90.4	0	0	0	111.6	P540 W544	P540-F542 PolarHBondContact O-N 3.39Å; F542-W544 PolarHBondContact O-N 3.02Å
543	N	26.1	Very low	26.3	Very low	92 Å²	92	141.2 Å²	141.2	49%	0.492	73%	0.733	S	S	.	*			trans	-85.4	108	179.9	-172.2	-0.6	0	0	0	111.1	S541 N545 S546	S541-N543 PolarHBondContact O-N 2.85Å; N543-N545 PolarHBondContact O-N 2.81Å; N543-N545 WeakPolarHBondContact OD1-CB 3.23Å; N543-N545 PolarHBondContact OD1-N 2.84Å; N543-N545 PolarHBondContact OD1-ND2 3.06Å; N543-S546 PolarHBondContact O-N 2.64Å; N543-S546 PolarHBondContact O-OG 3.5Å
544	W	29	Very low	26.3	Very low	240 Å²	240	141.1 Å²	141.1	91%	0.909	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-59.4	-13.6	179.1	-85.9	74.7	0	0	0	114.7	F542 S546	F542-W544 PolarHBondContact O-N 3.02Å; W544-S546 PolarHBondContact O-N 2.79Å
545	N	28.9	Very low	26.4	Very low	101 Å²	101	143.4 Å²	143.4	54%	0.54	74%	0.737	S	S	.	*	G	3₁₀ helix	trans	-74.1	-5.7	178.1	-66.8	-80	0	0	0	114.7	N543	N543-N545 PolarHBondContact O-N 2.81Å; N543-N545 WeakPolarHBondContact OD1-CB 3.23Å; N543-N545 PolarHBondContact OD1-N 2.84Å; N543-N545 PolarHBondContact OD1-ND2 3.06Å
546	S	25.9	Very low	26.3	Very low	91 Å²	91	146 Å²	146	64%	0.636	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-85.8	-15.5	-167.6	-61.9	0	0	0	0	116	N543 W544 R548	N543-S546 PolarHBondContact O-N 2.64Å; N543-S546 PolarHBondContact O-OG 3.5Å; W544-S546 PolarHBondContact O-N 2.79Å; S546-R548 PolarHBondContact O-N 3.45Å
547	V	26.9	Very low	26.2	Very low	124 Å²	124	143.8 Å²	143.8	75%	0.752	73%	0.734	S	S	*	*			trans	-85.7	57.3	178.9	-169.6	0	0	0	0	111	I549	V547-I549 HydrophobicContact CG1-CD1 4.32Å; V547-I549 HydrophobicContact CG1-CG1 4.04Å; V547-I549 PolarHBondContact O-N 2.94Å
548	R	24.3	Very low	26.1	Very low	204 Å²	204	143.3 Å²	143.3	77%	0.77	74%	0.736	S	S	*	*			trans	-79.7	80.2	175.2	-174.8	-174.1	-74.1	-174.8	-2.2	110	S546 Q550	S546-R548 PolarHBondContact O-N 3.45Å; R548-Q550 PolarHBondContact O-N 3.05Å
549	I	25.8	Very low	26.3	Very low	122 Å²	122	147.5 Å²	147.5	63%	0.626	74%	0.743	S	S	*	*			trans	-65.7	109.2	175.1	-57.7	-179.1	0	0	0	109.2	V547 Y551	V547-I549 HydrophobicContact CG1-CD1 4.32Å; V547-I549 HydrophobicContact CG1-CG1 4.04Å; V547-I549 PolarHBondContact O-N 2.94Å; I549-Y551 VanDerWaalsContact C-N 3.33Å; I549-Y551 HydrophobicContact CG2-CD2 3.69Å; I549-Y551 HydrophobicContact CG2-CE2 3.63Å; I549-Y551 PolarHBondContact O-N 2.97Å
550	Q	24.5	Very low	26.2	Very low	162 Å²	162	147.5 Å²	147.5	76%	0.757	74%	0.739	S	S	*	*			trans	-79.4	73.5	-169.8	-171	175	-12.7	0	0	111.9	R548 D552	R548-Q550 PolarHBondContact O-N 3.05Å; Q550-D552 PolarHBondContact O-N 3.09Å
551	Y	24.2	Very low	26.3	Very low	195 Å²	195	150.7 Å²	150.7	77%	0.765	74%	0.742	S	S	*	*			trans	-74.5	69.1	172.3	-89.8	-71.5	0	0	0	112.2	I549	I549-Y551 VanDerWaalsContact C-N 3.33Å; I549-Y551 HydrophobicContact CG2-CD2 3.69Å; I549-Y551 HydrophobicContact CG2-CE2 3.63Å; I549-Y551 PolarHBondContact O-N 2.97Å
552	D	28.1	Very low	26.5	Very low	128 Å²	128	151.4 Å²	151.4	68%	0.684	74%	0.744	S	S	*	*			trans	-72.7	131	172.6	-137	-32.9	0	0	0	110.5	Q550	Q550-D552 PolarHBondContact O-N 3.09Å
553	K	25.1	Very low	26.4	Very low	192 Å²	192	148.6 Å²	148.6	84%	0.835	74%	0.737	S	S	*	*			trans	-115.4	71.4	-168.6	-84.2	-170.9	174.3	178.2	0	112.6
554	S	27.5	Very low	26.5	Very low	85 Å²	85	151.3 Å²	151.3	59%	0.594	75%	0.751	S	S	*	*			trans	-155.6	129.5	164.9	56.3	0	0	0	0	114
555	N	29.2	Very low	26.6	Very low	148 Å²	148	147 Å²	147	79%	0.791	75%	0.747	S	S	*	*			trans	68.6	137.6	165.8	-42.5	-31.8	0	0	0	113.6
556	K	25.4	Very low	26.3	Very low	195 Å²	195	149.6 Å²	149.6	85%	0.848	76%	0.759	S	S	*	*			cis	60.8	133.7	41.5	-71.5	-159.2	170.8	-165.5	0	113.5
557	S	28.5	Very low	26.3	Very low	107 Å²	107	151 Å²	151	75%	0.748	77%	0.769	S	S	*	*			trans	55.2	113.1	-157.9	51.3	0	0	0	0	112.6
558	T	24.4	Very low	26.5	Very low	131 Å²	131	149.6 Å²	149.6	80%	0.804	77%	0.771	S	S	*	*				64.2	90.9	53.7	-48.1	0	0	0	0	111.7
559	Y	27.7	Very low	26.5	Very low	237 Å²	237	146.8 Å²	146.8	93%	0.929	77%	0.768	S	S	*	*			trans	-155.6	165.8	143.4	-102.7	-68.8	0	0	0	109.1
560	N	24.8	Very low	26.6	Very low	131 Å²	131	150.4 Å²	150.4	70%	0.701	77%	0.774	S	S	*	*			trans	-139.5	137.6	-150.9	-124.5	5.2	0	0	0	111.8
561	F	26.5	Very low	26.6	Very low	172 Å²	172	153.2 Å²	153.2	75%	0.754	78%	0.779	S	S	*	*			trans	63.5	168.8	160.7	-76.1	-76.4	0	0	0	117
562	P	29	Very low	26.8	Very low	128 Å²	128	149.1 Å²	149.1	83%	0.831	78%	0.779	S	S	*	*			cis	-111.2	165.1	6.8	40	-29	0	0	0	117.2
563	L	23.4	Very low	26.6	Very low	136 Å²	136	148.7 Å²	148.7	71%	0.712	78%	0.781	S	S	*	*			trans	-97.7	143.8	167.9	-167.1	83	0	0	0	108.5
564	N	27.4	Very low	26.6	Very low	148 Å²	148	145.3 Å²	145.3	79%	0.791	78%	0.777	S	S	*	*			trans	169.9	145.1	158.1	-90.2	-3.2	0	0	0	106.6
565	D	30.3	Very low	26.7	Very low	151 Å²	151	148.7 Å²	148.7	81%	0.807	79%	0.788	S	S	*	*			cis	-119.2	159.5	10.9	-72.5	-56	0	0	0	114.3
566	L	23.7	Very low	26.6	Very low	155 Å²	155	150.1 Å²	150.1	81%	0.812	79%	0.789	S	S	*	*			trans	-131.3	125.9	169	-111.4	167	0	0	0	107.6
567	S	25.8	Very low	27	Very low	120 Å²	120	146.2 Å²	146.2	84%	0.839	78%	0.784	S	S	*	*			trans	167	162.8	143.5	49.4	0	0	0	0	114.5
568	A	30.4	Very low	26.8	Very low	95 Å²	95	150.3 Å²	150.3	79%	0.785	79%	0.789	S	S	*	*			trans	73.4	140.7	163.2	0	0	0	0	0	120.2
569	M	25.3	Very low	26.9	Very low	144 Å²	144	149.9 Å²	149.9	71%	0.709	79%	0.786	S	S	*	*			cis	-164.7	142.8	-38.6	-123.2	-165.6	-167.5	0	0	111.7
570	R	27.9	Very low	26.7	Very low	198 Å²	198	143.6 Å²	143.6	75%	0.747	77%	0.772	S	S	*	*			trans	53.4	119.2	146.7	-67.5	172.4	177.9	165.5	-2.1	123.1
571	Y	24.1	Very low	26.9	Very low	221 Å²	221	143.6 Å²	143.6	87%	0.867	77%	0.772	S	S	*	*				28.1	122.4	127	-63.5	-86.9	0	0	0	123.2
572	S	27.6	Very low	26.9	Very low	109 Å²	109	143.7 Å²	143.7	76%	0.762	78%	0.775	S	S	*	*				174.8	108.3	123.4	52.9	0	0	0	0	110.9
573	T	24.5	Very low	26.8	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	77%	0.768	S	S	*	*				62.8	106.5	84.7	59.6	0	0	0	0	117.9
574	T	24.9	Very low	27.1	Very low	122 Å²	122	144 Å²	144	75%	0.748	77%	0.773	S	S	*	*			trans	54.5	119.9	143.8	54.2	0	0	0	0	121.8
575	N	29.2	Very low	27.2	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	77%	0.765	S	S	*	*				-170.9	173.9	110	-97.1	-34.8	0	0	0	113.9
576	H	27	Very low	27.3	Very low	178 Å²	178	139.5 Å²	139.5	82%	0.824	77%	0.765	S	S	*	*			trans	-92.2	-157.5	-171.8	-65.1	-99.7	0	0	0	113.4
577	P	34.8	Very low	27.6	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	76%	0.762	S	S	*	*				-133.4	-170.3	-92.7	42.7	-25.2	0	0	0	115.3
578	K	25.1	Very low	27.9	Very low	193 Å²	193	142.3 Å²	142.3	84%	0.839	75%	0.753	S	S	*	*			trans	83.8	153.2	151.1	-145.3	-178.1	-171.5	-179.4	0	116.7
579	V	24.8	Very low	28.1	Very low	122 Å²	122	143.3 Å²	143.3	74%	0.739	75%	0.749	S	S	*	*			trans	70.7	138.7	168.5	-174.9	0	0	0	0	115.7
580	T	25.1	Very low	28.5	Very low	104 Å²	104	141.7 Å²	141.7	64%	0.638	75%	0.747	S	S	*	*			cis	-160.7	-176.8	-38.5	39.6	0	0	0	0	107.3
581	D	27.5	Very low	28.6	Very low	132 Å²	132	139.1 Å²	139.1	71%	0.706	75%	0.748	S	S	*	*			trans	71.6	97.2	149.2	-49.5	-35.8	0	0	0	123.1
582	E	26.7	Very low	29	Very low	174 Å²	174	137.5 Å²	137.5	81%	0.813	75%	0.748	S	S	*	*				74.6	173.3	111.6	-134.2	179.9	-132.9	0	0	122.8
583	I	27	Very low	29.2	Very low	136 Å²	136	136.1 Å²	136.1	70%	0.697	74%	0.743	S	S	*	*			trans	78	98.6	163.5	-67.1	165.6	0	0	0	115.2
584	V	29.6	Very low	29.4	Very low	135 Å²	135	138.1 Å²	138.1	82%	0.818	75%	0.749	S	S	*	*				108	147.9	70.1	136	0	0	0	0	110.2
585	S	29.9	Very low	29.8	Very low	89 Å²	89	141 Å²	141	62%	0.622	75%	0.751	S	S	*	*			cis	-169.3	151.3	-15.4	175.1	0	0	0	0	111.3
586	S	32	Very low	30	Very low	115 Å²	115	140.3 Å²	140.3	80%	0.804	75%	0.747	S	S	*	*			trans	-164.6	105	144.9	-67.2	0	0	0	0	107.2
587	R	30.1	Very low	30.1	Very low	198 Å²	198	137.4 Å²	137.4	75%	0.747	74%	0.742	S	S	*	*				62.9	131.5	87	-76.1	-171.8	118.2	132.6	12.5	113.5
588	E	32.4	Very low	29.7	Very low	136 Å²	136	137.5 Å²	137.5	64%	0.636	74%	0.741	S	S	*	*			cis	-165.5	147.9	-0.7	-139.1	153.2	-156.5	0	0	105.4
589	V	34.2	Very low	29.8	Very low	116 Å²	116	135.2 Å²	135.2	70%	0.703	74%	0.736	S	S	*	*				177.1	132.5	77.6	163.5	0	0	0	0	108.9
590	T	33.8	Very low	29.9	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	74%	0.736	S	S	*	*			trans	12.6	157.4	151.2	69	0	0	0	0	122.4
591	D	30.3	Very low	30	Very low	145 Å²	145	133.6 Å²	133.6	78%	0.775	74%	0.735	S	S	*	*			cis	-170.2	179.2	-12.4	-94.5	-26.8	0	0	0	106.5
592	E	33.2	Very low	30	Very low	186 Å²	186	136.2 Å²	136.2	87%	0.869	74%	0.74	S	S	*	*			cis	-151	174.2	22.8	-153.6	176.3	-179.6	0	0	112.7
593	A	30.9	Very low	29.9	Very low	80 Å²	80	133.2 Å²	133.2	66%	0.661	73%	0.733	S	S	*	*			trans	-63.7	149.8	-169.6	0	0	0	0	0	115.5
594	L	29.2	Very low	29.9	Very low	161 Å²	161	133 Å²	133	84%	0.843	73%	0.734	S	S	*	*				57.4	110.1	58.9	-100.9	175.6	0	0	0	114.9
595	K	33.9	Very low	29.8	Very low	184 Å²	184	134.6 Å²	134.6	80%	0.8	73%	0.732	S	S	*	*			trans	-174.2	144	142.3	-105.7	151	-170.5	168.6	0	114.2
596	N	33.5	Very low	29.6	Very low	140 Å²	140	134.5 Å²	134.5	75%	0.749	74%	0.737	S	S	*	*			trans	63.8	141.1	154.4	-58.1	-4.3	0	0	0	118.8
597	T	27.3	Very low	29.4	Very low	116 Å²	116	135.3 Å²	135.3	71%	0.712	73%	0.732	S	S	*	*			cis	149.8	141.3	-19.6	35.3	0	0	0	0	108.1
598	T	26.8	Very low	29.2	Very low	117 Å²	117	134.6 Å²	134.6	72%	0.718	73%	0.734	S	S	*	*			trans	82.3	103.8	138.4	-67.2	0	0	0	0	122
599	I	27.3	Very low	28.9	Very low	145 Å²	145	132.6 Å²	132.6	74%	0.744	74%	0.736	S	S	*	*				78.1	134.5	129.7	-67.7	-178.6	0	0	0	121.8
600	S	27.3	Very low	28.6	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	74%	0.737	S	S	*	*			trans	66.9	163.8	156.3	-77.4	0	0	0	0	119.8
601	S	26.7	Very low	28.3	Very low	86 Å²	86	132.6 Å²	132.6	60%	0.601	74%	0.74	S	S	*	*			cis	-175.1	162.1	-32.8	65	0	0	0	0	108.7
602	K	27.5	Very low	28	Very low	186 Å²	186	132.6 Å²	132.6	81%	0.809	73%	0.733	S	S	*	*			trans	68.1	120.9	170.4	-62.4	175.4	-179.3	176.6	0	113.9
603	T	26	Very low	28	Very low	111 Å²	111	131.2 Å²	131.2	68%	0.681	73%	0.732	S	S	*	*				55.8	102.4	66.4	71.9	0	0	0	0	114.2
604	N	26.5	Very low	27.8	Very low	133 Å²	133	133.4 Å²	133.4	71%	0.711	73%	0.729	S	S	*	*				175.2	156.2	105.2	-92.2	-30.2	0	0	0	113.9
605	Q	26.9	Very low	27.7	Very low	168 Å²	168	130.1 Å²	130.1	79%	0.785	72%	0.719	S	S	*	*			trans	52.2	114.9	149.1	-64.7	160.1	12.7	0	0	118
606	A	25.5	Very low	27.3	Very low	87 Å²	87	131.1 Å²	131.1	72%	0.719	72%	0.724	S	S	*	*				68.8	101.2	58.7	0	0	0	0	0	114.7
607	N	28.2	Very low	27.1	Very low	132 Å²	132	131.4 Å²	131.4	71%	0.706	73%	0.725	S	S	*	*			trans	-171	136.6	147.4	-94.7	-45.2	0	0	0	106.8
608	K	26.2	Very low	27.2	Very low	182 Å²	182	133 Å²	133	79%	0.791	73%	0.729	S	S	*	*				51.5	132.9	89.9	-57	-179	-162.8	165.7	0	113.1
609	S	25.7	Very low	27.2	Very low	95 Å²	95	135.7 Å²	135.7	66%	0.664	73%	0.73	S	S	*	*			cis	-174.5	169	-0.8	43.8	0	0	0	0	109.9
610	S	27.1	Very low	27.2	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	74%	0.736	S	S	*	*			trans	64.4	158.3	154.5	58.9	0	0	0	0	116.8
611	T	27.6	Very low	27.2	Very low	120 Å²	120	136.4 Å²	136.4	74%	0.736	74%	0.737	S	S	*	*			cis	-147.8	162.9	3.6	-19.7	0	0	0	0	111.1
612	K	25.8	Very low	27.1	Very low	144 Å²	144	139.5 Å²	139.5	63%	0.626	74%	0.742	S	S	*	*			trans	-7.9	132.7	155	-64.8	170.5	163.3	-145	0	118.3	E614	K612-E614 HydrophobicContact CB-CG 4.33Å; K612-E614 VanDerWaalsContact CD-OE1 3.24Å; K612-E614 WeakPolarHBondContact CD-OE1 3.19Å; K612-E614 WeakPolarHBondContact CE-OE1 3.45Å; K612-E614 HydrophobicContact CG-CG 4.48Å; K612-E614 IonicContact NZ-OE1 2.64Å; K612-E614 PolarHBondContact NZ-OE1 3.42Å
613	N	32.3	Very low	27.2	Very low	158 Å²	158	137.8 Å²	137.8	85%	0.845	74%	0.742	S	S	*	*				-146.8	114.7	113	-84.9	-31.8	0	0	0	104.6
614	E	27.4	Very low	27.2	Very low	126 Å²	126	138.3 Å²	138.3	59%	0.589	74%	0.74	S	S	*	*				52.1	126.1	57.4	-62.8	-176.6	-179	0	0	112.9	K612	K612-E614 HydrophobicContact CB-CG 4.33Å; K612-E614 VanDerWaalsContact CD-OE1 3.24Å; K612-E614 WeakPolarHBondContact CD-OE1 3.19Å; K612-E614 WeakPolarHBondContact CE-OE1 3.45Å; K612-E614 HydrophobicContact CG-CG 4.48Å; K612-E614 IonicContact NZ-OE1 2.64Å; K612-E614 PolarHBondContact NZ-OE1 3.42Å
615	S	25.9	Very low	27.1	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	74%	0.743	S	S	*	*			cis	-176	110	-18	41.3	0	0	0	0	107.8
616	F	26.4	Very low	27	Very low	205 Å²	205	138.7 Å²	138.7	90%	0.899	74%	0.742	S	S	*	*			trans	-146.8	136.1	170.7	-97	-76	0	0	0	113.6
617	L	29.7	Very low	26.9	Very low	147 Å²	147	139.8 Å²	139.8	77%	0.77	74%	0.743	S	S	*	*			trans	69.8	45.9	165.1	-59.1	173	0	0	0	118.5	K619	L617-K619 PolarHBondContact O-N 2.89Å; L617-K619 VanDerWaalsContact O-N 3.11Å
618	N	27.7	Very low	26.7	Very low	149 Å²	149	137.8 Å²	137.8	80%	0.797	75%	0.745	S	S	*	*			trans	-57	105.4	136.2	-79.6	-15.2	0	0	0	108.6
619	K	28.4	Very low	26.6	Very low	173 Å²	173	134.5 Å²	134.5	75%	0.752	74%	0.74	S	S	*	*			trans	-157.3	6.2	169.5	-133.1	-177	179.5	-177.9	0	118.8	L617	L617-K619 PolarHBondContact O-N 2.89Å; L617-K619 VanDerWaalsContact O-N 3.11Å
620	V	27.3	Very low	26.5	Very low	144 Å²	144	139.9 Å²	139.9	87%	0.873	75%	0.745	S	S	*	*	S	Bend	trans	-135.8	32.3	173.1	-153.3	0	0	0	0	112
621	T	25.7	Very low	26.4	Very low	122 Å²	122	141.2 Å²	141.2	75%	0.748	74%	0.744	S	S	*	*	S	Bend	trans	-134.2	54.9	170.5	42	0	0	0	0	109.5
622	Q	26.1	Very low	26.3	Very low	151 Å²	151	140.9 Å²	140.9	71%	0.706	75%	0.747	S	S	*	*			trans	-149	139.7	173.9	-110.7	166.2	-15.3	0	0	108.6
623	N	28.6	Very low	26.3	Very low	151 Å²	151	138 Å²	138	81%	0.807	75%	0.745	S	S	*	*			trans	71.4	79	-160.8	-53.1	7.2	0	0	0	109.4
624	L	25.2	Very low	26.2	Very low	122 Å²	122	137 Å²	137	64%	0.639	74%	0.74	S	S	*	*			cis	52.3	102.6	47.2	-57.3	154.3	0	0	0	109.1
625	E	25.2	Very low	26.1	Very low	165 Å²	165	138.5 Å²	138.5	77%	0.771	75%	0.752	S	S	*	*				102.7	-178.6	103.4	-81.4	175.2	148.9	0	0	109
626	D	25.7	Very low	26.4	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	76%	0.756	S	S	*	*			trans	56.8	97.4	173.9	-67.9	-32.1	0	0	0	119.4
627	C	22.2	Very low	26.4	Very low	109 Å²	109	137.8 Å²	137.8	74%	0.736	75%	0.753	S	S	*	*				53.5	100.8	110.5	-59.8	0	0	0	0	118.4
628	A	23.6	Very low	26.5	Very low	91 Å²	91	138.6 Å²	138.6	75%	0.752	76%	0.757	S	S	*	*				62.3	154.1	113.1	0	0	0	0	0	121.7
629	V	24.8	Very low	26.6	Very low	113 Å²	113	139.9 Å²	139.9	69%	0.685	76%	0.758	S	S	*	*			trans	74.1	105	149.8	168.4	0	0	0	0	118.5
630	R	24.4	Very low	26.6	Very low	207 Å²	207	136.4 Å²	136.4	78%	0.781	76%	0.756	S	S	*	*			trans	73.6	121.3	136.5	-72.7	-179.8	-170.9	137.3	-0.5	122
631	N	24.6	Very low	26.7	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	74%	0.743	S	S	*	*				76.7	137.6	125	-60.5	1.2	0	0	0	120.6
632	S	25.7	Very low	26.7	Very low	113 Å²	113	136.9 Å²	136.9	79%	0.79	74%	0.744	S	S	*	*			trans	68.1	149.8	151	69.8	0	0	0	0	117.3
633	S	26	Very low	26.9	Very low	85 Å²	85	136.4 Å²	136.4	59%	0.594	74%	0.74	S	S	*	*			cis	-170.9	169.5	-19	46.1	0	0	0	0	109.2
634	N	29.1	Very low	27	Very low	137 Å²	137	135.7 Å²	135.7	73%	0.733	74%	0.74	S	S	*	*			trans	77.2	130	170.4	-43.8	-41.6	0	0	0	113.8
635	N	26.3	Very low	27.1	Very low	157 Å²	157	136.6 Å²	136.6	84%	0.84	74%	0.741	S	S	*	*			cis	85.1	82	41.7	-72.2	2.6	0	0	0	114.9
636	S	30.9	Very low	27.2	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	74%	0.737	S	S	*	*			trans	-166.1	127.6	132.8	40.1	0	0	0	0	106.4
637	E	26.8	Very low	27.5	Very low	177 Å²	177	134.6 Å²	134.6	83%	0.827	74%	0.737	S	S	*	*				54.9	123.4	81.3	-63	-174.1	129.8	0	0	112
638	L	31.4	Very low	27.6	Very low	163 Å²	163	135 Å²	135	85%	0.853	73%	0.731	S	S	*	*			cis	-130.6	146.7	37.5	-73.6	160.3	0	0	0	115.6
639	Q	29.8	Very low	27.7	Very low	176 Å²	176	139.7 Å²	139.7	82%	0.822	74%	0.738	S	S	*	*			trans	-87.6	153.3	150.5	-59.5	-179.8	5.4	0	0	109.7
640	S	28.9	Very low	27.8	Very low	100 Å²	100	139 Å²	139	70%	0.699	74%	0.738	S	S	*	*			trans	-171.5	115.2	130.2	38.9	0	0	0	0	109.7
641	E	29	Very low	27.8	Very low	129 Å²	129	134.8 Å²	134.8	60%	0.603	74%	0.74	S	S	*	*				85.6	154.3	90.7	-73.6	-169.6	134.4	0	0	113.4	K643	E641-K643 HydrophobicContact CG-CD 4.12Å; E641-K643 WeakPolarHBondContact OE1-CD 3.46Å; E641-K643 VanDerWaalsContact OE1-CE 3.31Å; E641-K643 WeakPolarHBondContact OE1-CE 3.48Å; E641-K643 IonicContact OE1-NZ 3.22Å; E641-K643 PolarHBondContact OE1-NZ 3.49Å
642	L	27	Very low	28	Very low	148 Å²	148	133.6 Å²	133.6	78%	0.775	74%	0.738	S	S	*	*			cis	-119.3	153.7	2.1	-78.4	86	0	0	0	109.8
643	K	29.5	Very low	28	Very low	141 Å²	141	133.5 Å²	133.5	61%	0.613	73%	0.728	S	S	*	*			cis	79.5	102	35.1	-68.3	-176.9	178.9	172.9	0	116.7	E641	E641-K643 HydrophobicContact CG-CD 4.12Å; E641-K643 WeakPolarHBondContact OE1-CD 3.46Å; E641-K643 VanDerWaalsContact OE1-CE 3.31Å; E641-K643 WeakPolarHBondContact OE1-CE 3.48Å; E641-K643 IonicContact OE1-NZ 3.22Å; E641-K643 PolarHBondContact OE1-NZ 3.49Å
644	V	31	Very low	28.1	Very low	135 Å²	135	137.3 Å²	137.3	82%	0.818	74%	0.742	S	S	*	*			trans	-151.4	95.4	135.3	-178.8	0	0	0	0	105.5
645	E	27.8	Very low	28.2	Very low	142 Å²	142	136.5 Å²	136.5	66%	0.664	74%	0.738	S	S	*	*				70.7	140.9	87.9	-69.5	-159.5	143.5	0	0	115.9
646	K	27.2	Very low	28.4	Very low	157 Å²	157	134.5 Å²	134.5	68%	0.683	73%	0.732	S	S	*	*			cis	-172.1	127.3	-18.5	-118.1	173.3	-168.8	163.9	0	109.5
647	S	31	Very low	28.7	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	74%	0.737	S	S	*	*			trans	165.6	96.6	152.9	50.7	0	0	0	0	108.2
648	N	24.4	Very low	29.3	Very low	116 Å²	116	138.5 Å²	138.5	62%	0.62	73%	0.732	S	S	*	*				76.4	131.6	60.7	-61.7	0.5	0	0	0	113.6
649	H	26.5	Very low	30.2	Very low	191 Å²	191	133.1 Å²	133.1	88%	0.884	71%	0.706	S	S	*	*			trans	69.1	129.2	177.8	-35	-71.3	0	0	0	113.8
650	S	26.6	Very low	30.8	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	70%	0.699	S	S	*	*			cis	-127.3	147.1	9.3	-173.9	0	0	0	0	112.4
651	S	25.1	Very low	31.6	Very low	119 Å²	119	131.1 Å²	131.1	83%	0.832	69%	0.691	S	S	*	*			trans	-93.8	99.3	171.1	54	0	0	0	0	110.6
652	T	27.1	Very low	33.2	Very low	108 Å²	108	130 Å²	130	66%	0.663	68%	0.684	S	S	*	*			trans	-129.9	55.5	-178.4	40.7	0	0	0	0	113.9
653	N	26.6	Very low	35	Very low	110 Å²	110	124.5 Å²	124.5	59%	0.588	65%	0.653	S	S	*	*			trans	50	69.1	145.6	-164.9	24.8	0	0	0	116.9	N655	N653-N655 PolarHBondContact O-N 3.01Å; N653-N655 PolarHBondContact OD1-ND2 3.2Å
654	D	28.8	Very low	36.4	Very low	165 Å²	165	120.1 Å²	120.1	88%	0.882	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	31.5	-179.9	-60.5	-65.5	0	0	0	115.9
655	N	30.5	Very low	37.8	Very low	121 Å²	121	116 Å²	116	65%	0.647	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-2.5	-174.2	-78	-57.6	0	0	0	114.8	N653	N653-N655 PolarHBondContact O-N 3.01Å; N653-N655 PolarHBondContact OD1-ND2 3.2Å
656	T	30	Very low	39.7	Very low	115 Å²	115	111.8 Å²	111.8	71%	0.706	60%	0.601	S	S	*	*			trans	-115.2	-6.5	-164.1	47.8	0	0	0	0	116.5
657	H	38.2	Very low	41.5	Very low	182 Å²	182	108 Å²	108	84%	0.843	59%	0.586	S	S	*	*	S	Bend	trans	-82.3	149.4	175.6	-115.5	3.8	0	0	0	112.8	P659	H657-P659 WeakPolarHBondContact O-CD 3.42Å
658	Y	38.6	Very low	43.1	Very low	182 Å²	182	107.6 Å²	107.6	71%	0.714	57%	0.574	S	S	*	*			trans	-73.4	119.3	-167	-89.6	-110.9	0	0	0	112	Y660 A661	Y658-Y660 PolarHBondContact O-N 3.45Å; Y658-A661 PolarHBondContact O-N 3.33Å
659	P	50	Low	45.1	Very low	50 Å²	50	107.1 Å²	107.1	33%	0.325	57%	0.572	S	S	.	*	H	α-helix	trans	-63.4	-26.2	174.2	27.3	-34.4	0	0	0	111.7	H657 A661 K662 Y663	H657-P659 WeakPolarHBondContact O-CD 3.42Å; P659-A661 VanDerWaalsContact C-N 3.32Å; P659-A661 PolarHBondContact O-N 3.49Å; P659-K662 WeakPolarHBondContact O-CB 3.19Å; P659-K662 PolarHBondContact O-N 3.26Å; P659-Y663 HydrophobicContact CB-CE2 4.14Å; P659-Y663 WeakPolarHBondContact O-CD2 3.27Å; P659-Y663 PolarHBondContact O-N 3.13Å
660	Y	43.4	Very low	46.8	Very low	171 Å²	171	98.1 Å²	98.1	67%	0.671	53%	0.531	S	S	*	.	H	α-helix	trans	-57.3	-40.8	174.8	-170.6	-108.8	0	0	0	112.9	Y658 K662 Y663 V664	Y658-Y660 PolarHBondContact O-N 3.45Å; Y660-K662 VanDerWaalsContact C-N 3.29Å; Y660-K662 PolarHBondContact O-N 2.82Å; Y660-Y663 PolarHBondContact O-N 2.96Å; Y660-V664 HydrophobicContact CD1-CG2 3.95Å; Y660-V664 HydrophobicContact CD2-CG2 4.45Å; Y660-V664 HydrophobicContact CE1-CG2 3.6Å; Y660-V664 HydrophobicContact CE2-CG2 4.14Å; Y660-V664 HydrophobicContact CG-CG2 4.36Å; Y660-V664 WeakPolarHBondContact O-CG2 3.29Å; Y660-V664 PolarHBondContact O-N 3.07Å
661	A	45.8	Very low	48.2	Very low	63 Å²	63	96.9 Å²	96.9	52%	0.521	52%	0.516	S	S	.	.	H	α-helix	trans	-63.4	-35.5	179.6	0	0	0	0	0	112.2	Y658 P659 A665	Y658-A661 PolarHBondContact O-N 3.33Å; P659-A661 VanDerWaalsContact C-N 3.32Å; P659-A661 PolarHBondContact O-N 3.49Å; A661-A665 WeakPolarHBondContact O-CB 3.42Å; A661-A665 PolarHBondContact O-N 3.13Å
662	K	63	Low	49.7	Very low	106 Å²	106	92.9 Å²	92.9	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-63.8	-52.1	172.5	-170.2	-145.2	169.9	-126.7	0	110.8	P659 Y660 V664 A665 D666 E694	P659-K662 WeakPolarHBondContact O-CB 3.19Å; P659-K662 PolarHBondContact O-N 3.26Å; Y660-K662 VanDerWaalsContact C-N 3.29Å; Y660-K662 PolarHBondContact O-N 2.82Å; K662-V664 VanDerWaalsContact C-N 3.33Å; K662-V664 PolarHBondContact O-N 3.44Å; K662-A665 WeakPolarHBondContact O-CB 3.31Å; K662-A665 PolarHBondContact O-N 3.44Å; K662-A665 VanDerWaalsContact O-N 3.15Å; K662-D666 WeakPolarHBondContact CE-OD2 3.41Å; K662-D666 IonicContact NZ-OD2 3.99Å; K662-D666 PolarHBondContact NZ-OD2 2.95Å; K662-D666 PolarHBondContact O-N 3.12Å; K662-E694 IonicContact NZ-OE2 2.65Å
663	Y	63.6	Low	51.7	Low	32 Å²	32	89.8 Å²	89.8	13%	0.125	47%	0.466	C	S	.	.	H	α-helix	trans	-61.8	-38.8	-179.5	-64.3	-57.3	0	0	0	112.8	P659 Y660 D666 M667 L691 E694 A695 A698	P659-Y663 HydrophobicContact CB-CE2 4.14Å; P659-Y663 WeakPolarHBondContact O-CD2 3.27Å; P659-Y663 PolarHBondContact O-N 3.13Å; Y660-Y663 PolarHBondContact O-N 2.96Å; Y663-D666 PolarHBondContact O-N 3.4Å; Y663-M667 WeakPolarHBondContact O-CB 3.43Å; Y663-M667 VanDerWaalsContact O-CG 3.26Å; Y663-M667 WeakPolarHBondContact O-CG 3.49Å; Y663-M667 PolarHBondContact O-N 3.44Å; Y663-L691 HydrophobicContact CD1-CD2 4Å; Y663-E694 HydrophobicContact CE1-CB 3.55Å; Y663-E694 PolarHBondContact OH-O 3.03Å; Y663-A695 HydrophobicContact CD2-CB 3.81Å; Y663-A695 HydrophobicContact CE2-CB 3.94Å; Y663-A695 HydrophobicContact CG-CB 4.13Å; Y663-A698 HydrophobicContact CE2-CB 4.11Å
664	V	58.8	Low	53.9	Low	49 Å²	49	88.1 Å²	88.1	30%	0.297	45%	0.451	S	S	.	.	H	α-helix	trans	-64.7	-41.1	174.6	171	0	0	0	0	111.5	Y660 K662 M667 I668	Y660-V664 HydrophobicContact CD1-CG2 3.95Å; Y660-V664 HydrophobicContact CD2-CG2 4.45Å; Y660-V664 HydrophobicContact CE1-CG2 3.6Å; Y660-V664 HydrophobicContact CE2-CG2 4.14Å; Y660-V664 HydrophobicContact CG-CG2 4.36Å; Y660-V664 WeakPolarHBondContact O-CG2 3.29Å; Y660-V664 PolarHBondContact O-N 3.07Å; K662-V664 VanDerWaalsContact C-N 3.33Å; K662-V664 PolarHBondContact O-N 3.44Å; V664-M667 PolarHBondContact O-N 3.33Å; V664-I668 HydrophobicContact CG1-CD1 3.79Å; V664-I668 HydrophobicContact CG1-CG1 4.49Å; V664-I668 WeakPolarHBondContact O-CB 3.28Å; V664-I668 VanDerWaalsContact O-CG1 3.24Å; V664-I668 WeakPolarHBondContact O-CG1 3.44Å; V664-I668 PolarHBondContact O-N 2.87Å
665	A	61.1	Low	55	Low	50 Å²	50	85.1 Å²	85.1	41%	0.413	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-47.5	173.9	0	0	0	0	0	111.9	A661 K662 M667 I668 D669	A661-A665 WeakPolarHBondContact O-CB 3.42Å; A661-A665 PolarHBondContact O-N 3.13Å; K662-A665 WeakPolarHBondContact O-CB 3.31Å; K662-A665 PolarHBondContact O-N 3.44Å; K662-A665 VanDerWaalsContact O-N 3.15Å; A665-M667 VanDerWaalsContact C-N 3.3Å; A665-M667 PolarHBondContact O-N 2.98Å; A665-I668 PolarHBondContact O-N 3.47Å; A665-D669 PolarHBondContact O-N 2.76Å
666	D	67.2	Low	56.3	Low	53 Å²	53	84.3 Å²	84.3	28%	0.283	43%	0.428	S	S	.	.	H	α-helix	trans	-59.6	-38.7	177.7	-67.7	-27.8	0	0	0	111.4	K662 Y663 A670 L691	K662-D666 WeakPolarHBondContact CE-OD2 3.41Å; K662-D666 IonicContact NZ-OD2 3.99Å; K662-D666 PolarHBondContact NZ-OD2 2.95Å; K662-D666 PolarHBondContact O-N 3.12Å; Y663-D666 PolarHBondContact O-N 3.4Å; D666-A670 WeakPolarHBondContact O-CB 3.42Å; D666-A670 PolarHBondContact O-N 2.79Å; D666-L691 HydrophobicContact CB-CD1 3.95Å; D666-L691 HydrophobicContact CB-CD2 3.56Å; D666-L691 HydrophobicContact CB-CG 4.44Å
667	M	66.3	Low	57.9	Low	76 Å²	76	81.8 Å²	81.8	37%	0.374	43%	0.425	S	S	.	.	H	α-helix	trans	-68.1	-42.5	173.9	-73.2	179.7	78.7	0	0	112.9	Y663 V664 A665 D669 A670 L671 F688 L691	Y663-M667 WeakPolarHBondContact O-CB 3.43Å; Y663-M667 VanDerWaalsContact O-CG 3.26Å; Y663-M667 WeakPolarHBondContact O-CG 3.49Å; Y663-M667 PolarHBondContact O-N 3.44Å; V664-M667 PolarHBondContact O-N 3.33Å; A665-M667 VanDerWaalsContact C-N 3.3Å; A665-M667 PolarHBondContact O-N 2.98Å; M667-D669 VanDerWaalsContact C-N 3.34Å; M667-A670 PolarHBondContact O-N 3.32Å; M667-L671 WeakPolarHBondContact O-CB 3.4Å; M667-L671 WeakPolarHBondContact O-CG 3.21Å; M667-L671 PolarHBondContact O-N 3.22Å; M667-F688 HydrophobicContact CB-CE1 4.18Å; M667-F688 HydrophobicContact CE-CD1 4.35Å; M667-F688 HydrophobicContact CE-CE1 4.06Å; M667-F688 HydrophobicContact CE-CE2 4.41Å; M667-F688 HydrophobicContact CE-CZ 4.08Å; M667-F688 HydrophobicContact CG-CD1 4.4Å; M667-F688 HydrophobicContact CG-CE1 4.16Å; M667-L691 HydrophobicContact CG-CD1 3.77Å
668	I	62.7	Low	59.5	Low	102 Å²	102	79.8 Å²	79.8	52%	0.523	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-42	176.8	-73.5	166.8	0	0	0	110.4	V664 A665 L671 S672	V664-I668 HydrophobicContact CG1-CD1 3.79Å; V664-I668 HydrophobicContact CG1-CG1 4.49Å; V664-I668 WeakPolarHBondContact O-CB 3.28Å; V664-I668 VanDerWaalsContact O-CG1 3.24Å; V664-I668 WeakPolarHBondContact O-CG1 3.44Å; V664-I668 PolarHBondContact O-N 2.87Å; A665-I668 PolarHBondContact O-N 3.47Å; I668-L671 PolarHBondContact O-N 3.33Å; I668-S672 WeakPolarHBondContact O-CB 3.33Å; I668-S672 PolarHBondContact O-N 2.87Å
669	D	67.4	Low	61.2	Low	106 Å²	106	71.9 Å²	71.9	57%	0.567	38%	0.384	S	S	*	.	H	α-helix	trans	-66.3	-43.7	177	-93.2	-6.9	0	0	0	111.4	A665 M667 L671 S672 E673	A665-D669 PolarHBondContact O-N 2.76Å; M667-D669 VanDerWaalsContact C-N 3.34Å; D669-L671 PolarHBondContact O-N 3.07Å; D669-S672 CarbonylContact O-C 3.5Å; D669-S672 WeakPolarHBondContact O-CA 3.49Å; D669-S672 WeakPolarHBondContact O-CB 3.21Å; D669-S672 PolarHBondContact O-N 3.44Å; D669-S672 PolarHBondContact O-OG 2.84Å; D669-E673 VanDerWaalsContact O-CG 3.28Å; D669-E673 WeakPolarHBondContact O-CG 3.27Å; D669-E673 PolarHBondContact O-N 3.23Å
670	A	62.2	Low	62.8	Low	3 Å²	3	71.7 Å²	71.7	3%	0.025	38%	0.384	C	S	.	.	H	α-helix	trans	-59	-44.6	174.1	0	0	0	0	0	112.6	D666 M667 S672 E673 R674 L684 F688	D666-A670 WeakPolarHBondContact O-CB 3.42Å; D666-A670 PolarHBondContact O-N 2.79Å; M667-A670 PolarHBondContact O-N 3.32Å; A670-S672 VanDerWaalsContact C-N 3.31Å; A670-S672 PolarHBondContact O-N 3.11Å; A670-E673 PolarHBondContact O-N 3.31Å; A670-R674 PolarHBondContact O-N 3.16Å; A670-L684 HydrophobicContact CB-CD1 3.92Å; A670-F688 HydrophobicContact CB-CE1 4.42Å
671	L	56.6	Low	64.2	Low	71 Å²	71	69 Å²	69	37%	0.372	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-38.8	171.9	-75.7	168.9	0	0	0	112	M667 I668 D669 E673 R674 L675 L684 F688	M667-L671 WeakPolarHBondContact O-CB 3.4Å; M667-L671 WeakPolarHBondContact O-CG 3.21Å; M667-L671 PolarHBondContact O-N 3.22Å; I668-L671 PolarHBondContact O-N 3.33Å; D669-L671 PolarHBondContact O-N 3.07Å; L671-E673 VanDerWaalsContact C-N 3.33Å; L671-E673 PolarHBondContact O-N 2.81Å; L671-R674 PolarHBondContact O-N 2.72Å; L671-L675 VanDerWaalsContact O-CB 3.31Å; L671-L675 WeakPolarHBondContact O-CB 3.44Å; L671-L675 VanDerWaalsContact O-CG 3.24Å; L671-L675 WeakPolarHBondContact O-CG 3.32Å; L671-L675 PolarHBondContact O-N 3.36Å; L671-L684 HydrophobicContact CD2-CD1 4.32Å; L671-L684 HydrophobicContact CD2-CD2 4.02Å; L671-F688 HydrophobicContact CD1-CZ 4.13Å; L671-F688 HydrophobicContact CD2-CZ 3.81Å; L671-F688 HydrophobicContact CG-CE1 4.28Å; L671-F688 HydrophobicContact CG-CZ 3.75Å
672	S	56.7	Low	65.7	Low	35 Å²	35	72.2 Å²	72.2	25%	0.245	39%	0.385	C	S	.	.	H	α-helix	trans	-64.3	-38.4	175.4	93.9	0	0	0	0	111.8	I668 D669 A670 M676	I668-S672 WeakPolarHBondContact O-CB 3.33Å; I668-S672 PolarHBondContact O-N 2.87Å; D669-S672 CarbonylContact O-C 3.5Å; D669-S672 WeakPolarHBondContact O-CA 3.49Å; D669-S672 WeakPolarHBondContact O-CB 3.21Å; D669-S672 PolarHBondContact O-N 3.44Å; D669-S672 PolarHBondContact O-OG 2.84Å; A670-S672 VanDerWaalsContact C-N 3.31Å; A670-S672 PolarHBondContact O-N 3.11Å; S672-M676 VanDerWaalsContact O-CB 3.26Å; S672-M676 WeakPolarHBondContact O-CB 3.46Å; S672-M676 WeakPolarHBondContact O-CG 3.4Å; S672-M676 PolarHBondContact O-N 2.97Å
673	E	68.2	Low	66.5	Low	43 Å²	43	70.6 Å²	70.6	20%	0.201	38%	0.382	C	S	.	.	H	α-helix	trans	-67.8	-42.2	177.2	-61.9	-139.1	116	0	0	111.1	D669 A670 L671 M676 G677 K678 I679 R687	D669-E673 VanDerWaalsContact O-CG 3.28Å; D669-E673 WeakPolarHBondContact O-CG 3.27Å; D669-E673 PolarHBondContact O-N 3.23Å; A670-E673 PolarHBondContact O-N 3.31Å; L671-E673 VanDerWaalsContact C-N 3.33Å; L671-E673 PolarHBondContact O-N 2.81Å; E673-M676 CarbonylContact O-C 3.57Å; E673-M676 PolarHBondContact O-N 3.14Å; E673-G677 PolarHBondContact O-N 2.74Å; E673-G677 VanDerWaalsContact O-N 3.11Å; E673-K678 HydrophobicContact CB-CB 4.12Å; E673-K678 HydrophobicContact CB-CD 3.99Å; E673-K678 HydrophobicContact CG-CD 3.87Å; E673-K678 PolarHBondContact O-N 3Å; E673-K678 WeakPolarHBondContact OE1-CD 3.28Å; E673-K678 WeakPolarHBondContact OE1-CE 3.23Å; E673-K678 IonicContact OE1-NZ 2.79Å; E673-K678 PolarHBondContact OE1-NZ 3.37Å; E673-I679 HydrophobicContact CB-CD1 4.08Å; E673-I679 HydrophobicContact CB-CG1 4.06Å; E673-I679 HydrophobicContact CB-CG2 4.17Å; E673-R687 IonicContact OE2-CZ 3.06Å; E673-R687 VanDerWaalsContact OE2-CZ 3.29Å; E673-R687 IonicContact OE2-NH1 3.73Å; E673-R687 PolarHBondContact OE2-NH1 3.16Å; E673-R687 IonicContact OE2-NH2 3.82Å; E673-R687 PolarHBondContact OE2-NH2 3.08Å
674	R	73.2	Confident	67.3	Low	76 Å²	76	70 Å²	70	29%	0.287	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-49.1	174	178.9	76.2	-169.6	86.4	2.9	111.5	A670 L671 M676 G677 I679 S680 E681 L684	A670-R674 PolarHBondContact O-N 3.16Å; L671-R674 PolarHBondContact O-N 2.72Å; R674-M676 PolarHBondContact O-N 3.35Å; R674-G677 PolarHBondContact O-N 3.02Å; R674-I679 HydrophobicContact CB-CD1 4.25Å; R674-I679 HydrophobicContact CB-CG1 4.01Å; R674-S680 WeakPolarHBondContact CD-O 3.44Å; R674-E681 IonicContact CZ-OE1 3.29Å; R674-E681 VanDerWaalsContact CZ-OE1 3.26Å; R674-E681 IonicContact CZ-OE2 2.93Å; R674-E681 IonicContact NE-OE1 2.73Å; R674-E681 PolarHBondContact NE-OE1 3.37Å; R674-E681 IonicContact NE-OE2 2.89Å; R674-E681 IonicContact NH2-OE1 3.55Å; R674-E681 PolarHBondContact NH2-OE1 3.43Å; R674-E681 IonicContact NH2-OE2 3.74Å; R674-E681 PolarHBondContact NH2-OE2 2.81Å; R674-L684 HydrophobicContact CB-CB 4.49Å; R674-L684 HydrophobicContact CB-CD1 4.39Å; R674-L684 HydrophobicContact CB-CD2 4.12Å; R674-L684 HydrophobicContact CG-CB 4.49Å; R674-L684 HydrophobicContact CG-CD2 3.87Å
675	L	50.7	Low	68.2	Low	102 Å²	102	72 Å²	72	53%	0.534	39%	0.387	S	S	.	.	H	α-helix	trans	-65.1	-24.3	178.6	-74.3	169.8	0	0	0	113.4	L671	L671-L675 VanDerWaalsContact O-CB 3.31Å; L671-L675 WeakPolarHBondContact O-CB 3.44Å; L671-L675 VanDerWaalsContact O-CG 3.24Å; L671-L675 WeakPolarHBondContact O-CG 3.32Å; L671-L675 PolarHBondContact O-N 3.36Å
676	M	59.4	Low	69.3	Low	104 Å²	104	74.3 Å²	74.3	51%	0.512	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-3	173.3	-70.9	-68.9	-67.1	0	0	113.4	L356 S672 E673 R674 K678	L356-M676 HydrophobicContact CD1-SD 4.24Å; S672-M676 VanDerWaalsContact O-CB 3.26Å; S672-M676 WeakPolarHBondContact O-CB 3.46Å; S672-M676 WeakPolarHBondContact O-CG 3.4Å; S672-M676 PolarHBondContact O-N 2.97Å; E673-M676 CarbonylContact O-C 3.57Å; E673-M676 PolarHBondContact O-N 3.14Å; R674-M676 PolarHBondContact O-N 3.35Å; M676-K678 VanDerWaalsContact C-N 3.33Å; M676-K678 HydrophobicContact CB-CG 4.32Å
677	G	63.1	Low	70	Confident	61 Å²	61	76 Å²	76	63%	0.629	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	25.9	-179.7	0	0	0	0	0	114.2	E673 R674	E673-G677 PolarHBondContact O-N 2.74Å; E673-G677 VanDerWaalsContact O-N 3.11Å; R674-G677 PolarHBondContact O-N 3.02Å
678	K	71.2	Confident	71	Confident	141 Å²	141	74.9 Å²	74.9	61%	0.613	39%	0.387	S	S	*	.	S	Bend	trans	-82.2	-27.9	175.6	-66.9	178.9	173.4	176.3	0	113.2	E673 M676	E673-K678 HydrophobicContact CB-CB 4.12Å; E673-K678 HydrophobicContact CB-CD 3.99Å; E673-K678 HydrophobicContact CG-CD 3.87Å; E673-K678 PolarHBondContact O-N 3Å; E673-K678 WeakPolarHBondContact OE1-CD 3.28Å; E673-K678 WeakPolarHBondContact OE1-CE 3.23Å; E673-K678 IonicContact OE1-NZ 2.79Å; E673-K678 PolarHBondContact OE1-NZ 3.37Å; M676-K678 VanDerWaalsContact C-N 3.33Å; M676-K678 HydrophobicContact CB-CG 4.32Å
679	I	74.4	Confident	71.9	Confident	16 Å²	16	74.8 Å²	74.8	8%	0.082	38%	0.384	C	S	.	.	S	Bend	trans	-129	153.6	-178.1	67.7	172.5	0	0	0	109.7	E673 R674 D683 L684	E673-I679 HydrophobicContact CB-CD1 4.08Å; E673-I679 HydrophobicContact CB-CG1 4.06Å; E673-I679 HydrophobicContact CB-CG2 4.17Å; R674-I679 HydrophobicContact CB-CD1 4.25Å; R674-I679 HydrophobicContact CB-CG1 4.01Å; I679-D683 HydrophobicContact CB-CB 3.7Å; I679-D683 HydrophobicContact CD1-CB 4.41Å; I679-D683 HydrophobicContact CG1-CB 4.39Å; I679-D683 HydrophobicContact CG2-CB 4.45Å; I679-L684 HydrophobicContact CD1-CB 4.12Å; I679-L684 HydrophobicContact CD1-CD1 4.33Å
680	S	83.8	Confident	72.6	Confident	46 Å²	46	73.8 Å²	73.8	32%	0.322	38%	0.378	S	S	.	.			trans	-74.3	-179.9	176.3	66.6	0	0	0	0	112.8	R674 D682 D683 L684	R674-S680 WeakPolarHBondContact CD-O 3.44Å; S680-D682 PolarHBondContact OG-N 3.21Å; S680-D683 VanDerWaalsContact CB-OD2 3.3Å; S680-D683 WeakPolarHBondContact CB-OD2 3.38Å; S680-D683 PolarHBondContact N-OD2 2.99Å; S680-D683 WeakPolarHBondContact OG-CB 3.42Å; S680-D683 PolarHBondContact OG-N 2.93Å; S680-D683 PolarHBondContact OG-OD2 3.46Å; S680-L684 PolarHBondContact O-N 3.12Å
681	E	73.9	Confident	73.4	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	38%	0.382	S	S	.	.	H	α-helix	trans	-64.3	-49.6	167.9	-144	82.3	-99.9	0	0	109.4	R674 D683 L684 E685	R674-E681 IonicContact CZ-OE1 3.29Å; R674-E681 VanDerWaalsContact CZ-OE1 3.26Å; R674-E681 IonicContact CZ-OE2 2.93Å; R674-E681 IonicContact NE-OE1 2.73Å; R674-E681 PolarHBondContact NE-OE1 3.37Å; R674-E681 IonicContact NE-OE2 2.89Å; R674-E681 IonicContact NH2-OE1 3.55Å; R674-E681 PolarHBondContact NH2-OE1 3.43Å; R674-E681 IonicContact NH2-OE2 3.74Å; R674-E681 PolarHBondContact NH2-OE2 2.81Å; E681-D683 VanDerWaalsContact C-N 3.31Å; E681-D683 PolarHBondContact O-N 2.78Å; E681-L684 WeakPolarHBondContact O-CB 3.22Å; E681-L684 PolarHBondContact O-N 2.8Å; E681-E685 PolarHBondContact O-N 2.96Å
682	D	75.7	Confident	74.3	Confident	129 Å²	129	77.8 Å²	77.8	69%	0.69	40%	0.395	S	S	*	.	H	α-helix	trans	-59.4	-38.5	-179.5	-43.1	-23.5	0	0	0	112.3	S680 L686	S680-D682 PolarHBondContact OG-N 3.21Å; D682-L686 VanDerWaalsContact O-CB 3.24Å; D682-L686 WeakPolarHBondContact O-CB 3.27Å; D682-L686 PolarHBondContact O-N 2.99Å
683	D	79.8	Confident	75.1	Confident	72 Å²	72	78.1 Å²	78.1	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-67	-34.7	173.7	-71.5	-60.6	0	0	0	113	I679 S680 E681 R687	I679-D683 HydrophobicContact CB-CB 3.7Å; I679-D683 HydrophobicContact CD1-CB 4.41Å; I679-D683 HydrophobicContact CG1-CB 4.39Å; I679-D683 HydrophobicContact CG2-CB 4.45Å; S680-D683 VanDerWaalsContact CB-OD2 3.3Å; S680-D683 WeakPolarHBondContact CB-OD2 3.38Å; S680-D683 PolarHBondContact N-OD2 2.99Å; S680-D683 WeakPolarHBondContact OG-CB 3.42Å; S680-D683 PolarHBondContact OG-N 2.93Å; S680-D683 PolarHBondContact OG-OD2 3.46Å; E681-D683 VanDerWaalsContact C-N 3.31Å; E681-D683 PolarHBondContact O-N 2.78Å; D683-R687 WeakPolarHBondContact O-CB 3.02Å; D683-R687 WeakPolarHBondContact O-CG 3.45Å; D683-R687 PolarHBondContact O-N 2.86Å; D683-R687 VanDerWaalsContact O-N 3.07Å
684	L	80.7	Confident	75.4	Confident	20 Å²	20	79.7 Å²	79.7	11%	0.105	41%	0.407	C	S	.	.	H	α-helix	trans	-69.4	-47.3	176.7	176.6	68.4	0	0	0	109.6	A670 L671 R674 I679 S680 E681 R687 F688	A670-L684 HydrophobicContact CB-CD1 3.92Å; L671-L684 HydrophobicContact CD2-CD1 4.32Å; L671-L684 HydrophobicContact CD2-CD2 4.02Å; R674-L684 HydrophobicContact CB-CB 4.49Å; R674-L684 HydrophobicContact CB-CD1 4.39Å; R674-L684 HydrophobicContact CB-CD2 4.12Å; R674-L684 HydrophobicContact CG-CB 4.49Å; R674-L684 HydrophobicContact CG-CD2 3.87Å; I679-L684 HydrophobicContact CD1-CB 4.12Å; I679-L684 HydrophobicContact CD1-CD1 4.33Å; S680-L684 PolarHBondContact O-N 3.12Å; E681-L684 WeakPolarHBondContact O-CB 3.22Å; E681-L684 PolarHBondContact O-N 2.8Å; L684-R687 PolarHBondContact O-N 2.89Å; L684-F688 HydrophobicContact CD1-CD1 4Å; L684-F688 HydrophobicContact CD1-CE1 3.63Å; L684-F688 HydrophobicContact CD1-CE2 4.39Å; L684-F688 HydrophobicContact CD1-CZ 3.86Å; L684-F688 HydrophobicContact CD2-CE2 4.46Å; L684-F688 HydrophobicContact CG-CD2 4.49Å; L684-F688 HydrophobicContact CG-CE1 4.37Å; L684-F688 HydrophobicContact CG-CE2 4.35Å; L684-F688 HydrophobicContact CG-CZ 4.31Å; L684-F688 PolarHBondContact O-N 3Å
685	E	78.4	Confident	75	Confident	92 Å²	92	77.7 Å²	77.7	43%	0.43	41%	0.407	S	S	.	.	H	α-helix	trans	-61.2	-46.4	178.6	-179.2	53.4	-153.2	0	0	111.1	E681 R687 F688 Q689	E681-E685 PolarHBondContact O-N 2.96Å; E685-R687 VanDerWaalsContact C-N 3.33Å; E685-R687 PolarHBondContact O-N 2.71Å; E685-F688 PolarHBondContact O-N 3.11Å; E685-F688 VanDerWaalsContact O-N 3.15Å; E685-Q689 WeakPolarHBondContact O-CG 3.5Å; E685-Q689 PolarHBondContact O-N 2.93Å; E685-Q689 PolarHBondContact OE1-NE2 3.16Å
686	L	83	Confident	75.8	Confident	97 Å²	97	75.2 Å²	75.2	51%	0.508	40%	0.399	S	S	.	.	H	α-helix	trans	-58.4	-42.1	173.9	-179.9	62.1	0	0	0	112.3	D682 I690	D682-L686 VanDerWaalsContact O-CB 3.24Å; D682-L686 WeakPolarHBondContact O-CB 3.27Å; D682-L686 PolarHBondContact O-N 2.99Å; L686-I690 HydrophobicContact CD1-CD1 4.22Å; L686-I690 HydrophobicContact CG-CD1 4.08Å; L686-I690 WeakPolarHBondContact O-CD1 3.15Å; L686-I690 VanDerWaalsContact O-CG1 3.23Å; L686-I690 WeakPolarHBondContact O-CG1 3.13Å; L686-I690 PolarHBondContact O-N 3.27Å
687	R	83.3	Confident	76.3	Confident	90 Å²	90	76.7 Å²	76.7	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-66.5	-39.2	175.7	-76.8	174.7	-179.3	-154.6	11	112.1	E673 D683 L684 E685 I690 L691	E673-R687 IonicContact OE2-CZ 3.06Å; E673-R687 VanDerWaalsContact OE2-CZ 3.29Å; E673-R687 IonicContact OE2-NH1 3.73Å; E673-R687 PolarHBondContact OE2-NH1 3.16Å; E673-R687 IonicContact OE2-NH2 3.82Å; E673-R687 PolarHBondContact OE2-NH2 3.08Å; D683-R687 WeakPolarHBondContact O-CB 3.02Å; D683-R687 WeakPolarHBondContact O-CG 3.45Å; D683-R687 PolarHBondContact O-N 2.86Å; D683-R687 VanDerWaalsContact O-N 3.07Å; L684-R687 PolarHBondContact O-N 2.89Å; E685-R687 VanDerWaalsContact C-N 3.33Å; E685-R687 PolarHBondContact O-N 2.71Å; R687-I690 PolarHBondContact O-N 2.8Å; R687-L691 WeakPolarHBondContact O-CB 3.43Å; R687-L691 VanDerWaalsContact O-CG 3.25Å; R687-L691 WeakPolarHBondContact O-CG 3.43Å; R687-L691 PolarHBondContact O-N 2.73Å
688	F	86.5	Confident	76.2	Confident	51 Å²	51	75.1 Å²	75.1	22%	0.224	38%	0.383	C	S	.	.	H	α-helix	trans	-64.8	-45.4	176	-81.7	6.3	0	0	0	111.6	M667 A670 L671 L684 E685 I690 L691 E692	M667-F688 HydrophobicContact CB-CE1 4.18Å; M667-F688 HydrophobicContact CE-CD1 4.35Å; M667-F688 HydrophobicContact CE-CE1 4.06Å; M667-F688 HydrophobicContact CE-CE2 4.41Å; M667-F688 HydrophobicContact CE-CZ 4.08Å; M667-F688 HydrophobicContact CG-CD1 4.4Å; M667-F688 HydrophobicContact CG-CE1 4.16Å; A670-F688 HydrophobicContact CB-CE1 4.42Å; L671-F688 HydrophobicContact CD1-CZ 4.13Å; L671-F688 HydrophobicContact CD2-CZ 3.81Å; L671-F688 HydrophobicContact CG-CE1 4.28Å; L671-F688 HydrophobicContact CG-CZ 3.75Å; L684-F688 HydrophobicContact CD1-CD1 4Å; L684-F688 HydrophobicContact CD1-CE1 3.63Å; L684-F688 HydrophobicContact CD1-CE2 4.39Å; L684-F688 HydrophobicContact CD1-CZ 3.86Å; L684-F688 HydrophobicContact CD2-CE2 4.46Å; L684-F688 HydrophobicContact CG-CD2 4.49Å; L684-F688 HydrophobicContact CG-CE1 4.37Å; L684-F688 HydrophobicContact CG-CE2 4.35Å; L684-F688 HydrophobicContact CG-CZ 4.31Å; L684-F688 PolarHBondContact O-N 3Å; E685-F688 PolarHBondContact O-N 3.11Å; E685-F688 VanDerWaalsContact O-N 3.15Å; F688-I690 VanDerWaalsContact C-N 3.32Å; F688-I690 PolarHBondContact O-N 3.27Å; F688-L691 PolarHBondContact O-N 3.16Å; F688-E692 WeakPolarHBondContact O-CB 3.2Å; F688-E692 PolarHBondContact O-N 2.88Å
689	Q	81.4	Confident	75.5	Confident	100 Å²	100	71.5 Å²	71.5	47%	0.467	38%	0.38	S	S	.	.	H	α-helix	trans	-60.8	-38.8	174.5	-69	177	14	0	0	112.4	E685 A693	E685-Q689 WeakPolarHBondContact O-CG 3.5Å; E685-Q689 PolarHBondContact O-N 2.93Å; E685-Q689 PolarHBondContact OE1-NE2 3.16Å; Q689-A693 WeakPolarHBondContact O-CB 3.04Å; Q689-A693 PolarHBondContact O-N 2.97Å
690	I	81.9	Confident	74.4	Confident	86 Å²	86	78.4 Å²	78.4	44%	0.441	41%	0.409	S	S	.	.	H	α-helix	trans	-64.2	-47.1	173.9	-71	164.6	0	0	0	110.9	L686 R687 F688 A693 E694	L686-I690 HydrophobicContact CD1-CD1 4.22Å; L686-I690 HydrophobicContact CG-CD1 4.08Å; L686-I690 WeakPolarHBondContact O-CD1 3.15Å; L686-I690 VanDerWaalsContact O-CG1 3.23Å; L686-I690 WeakPolarHBondContact O-CG1 3.13Å; L686-I690 PolarHBondContact O-N 3.27Å; R687-I690 PolarHBondContact O-N 2.8Å; F688-I690 VanDerWaalsContact C-N 3.32Å; F688-I690 PolarHBondContact O-N 3.27Å; I690-A693 PolarHBondContact O-N 3.32Å; I690-E694 PolarHBondContact O-N 3.04Å
691	L	79.4	Confident	72.9	Confident	19 Å²	19	83.9 Å²	83.9	10%	0.099	43%	0.429	C	S	.	.	H	α-helix	trans	-66.9	-38.4	-179.5	-70.2	167.9	0	0	0	112.3	Y663 D666 M667 R687 F688 E694 A695	Y663-L691 HydrophobicContact CD1-CD2 4Å; D666-L691 HydrophobicContact CB-CD1 3.95Å; D666-L691 HydrophobicContact CB-CD2 3.56Å; D666-L691 HydrophobicContact CB-CG 4.44Å; M667-L691 HydrophobicContact CG-CD1 3.77Å; R687-L691 WeakPolarHBondContact O-CB 3.43Å; R687-L691 VanDerWaalsContact O-CG 3.25Å; R687-L691 WeakPolarHBondContact O-CG 3.43Å; R687-L691 PolarHBondContact O-N 2.73Å; F688-L691 PolarHBondContact O-N 3.16Å; L691-E694 PolarHBondContact O-N 3.26Å; L691-A695 VanDerWaalsContact O-CB 3.27Å; L691-A695 WeakPolarHBondContact O-CB 3.23Å; L691-A695 PolarHBondContact O-N 3.31Å
692	E	74.8	Confident	71.3	Confident	138 Å²	138	84.3 Å²	84.3	65%	0.645	43%	0.429	S	S	*	.	H	α-helix	trans	-66.5	-40.7	173.2	-176.1	173.7	-147.7	0	0	111.6	F688 A695 S696	F688-E692 WeakPolarHBondContact O-CB 3.2Å; F688-E692 PolarHBondContact O-N 2.88Å; E692-A695 PolarHBondContact O-N 2.98Å; E692-S696 WeakPolarHBondContact O-CB 3.41Å; E692-S696 PolarHBondContact O-N 3.01Å; E692-S696 PolarHBondContact O-OG 2.91Å
693	A	74.8	Confident	69.4	Low	42 Å²	42	84.1 Å²	84.1	35%	0.347	43%	0.433	S	S	.	.	H	α-helix	trans	-66.7	-37.1	175.3	0	0	0	0	0	112.5	Q689 I690 K697	Q689-A693 WeakPolarHBondContact O-CB 3.04Å; Q689-A693 PolarHBondContact O-N 2.97Å; I690-A693 PolarHBondContact O-N 3.32Å; A693-K697 WeakPolarHBondContact O-CD 3.24Å; A693-K697 WeakPolarHBondContact O-CG 3.37Å; A693-K697 PolarHBondContact O-N 2.92Å; A693-K697 VanDerWaalsContact O-N 3.08Å
694	E	73.7	Confident	67.1	Low	76 Å²	76	85.2 Å²	85.2	36%	0.355	45%	0.452	S	S	.	.	H	α-helix	trans	-67.8	-48.9	172.2	-77.9	-166	-167	0	0	112	K662 Y663 I690 L691 S696 K697 A698	K662-E694 IonicContact NZ-OE2 2.65Å; Y663-E694 HydrophobicContact CE1-CB 3.55Å; Y663-E694 PolarHBondContact OH-O 3.03Å; I690-E694 PolarHBondContact O-N 3.04Å; L691-E694 PolarHBondContact O-N 3.26Å; E694-S696 VanDerWaalsContact C-N 3.27Å; E694-S696 PolarHBondContact O-N 3.3Å; E694-K697 WeakPolarHBondContact O-CB 3.42Å; E694-K697 PolarHBondContact O-N 3.44Å; E694-K697 VanDerWaalsContact O-N 3.08Å; E694-A698 WeakPolarHBondContact O-CB 3.39Å; E694-A698 PolarHBondContact O-N 2.96Å
695	A	65.8	Low	64.6	Low	35 Å²	35	91.5 Å²	91.5	29%	0.289	48%	0.481	S	S	.	.	H	α-helix	trans	-58.8	-40.6	176.8	0	0	0	0	0	111.6	Y663 L691 E692 A698 A699	Y663-A695 HydrophobicContact CD2-CB 3.81Å; Y663-A695 HydrophobicContact CE2-CB 3.94Å; Y663-A695 HydrophobicContact CG-CB 4.13Å; L691-A695 VanDerWaalsContact O-CB 3.27Å; L691-A695 WeakPolarHBondContact O-CB 3.23Å; L691-A695 PolarHBondContact O-N 3.31Å; E692-A695 PolarHBondContact O-N 2.98Å; A695-A698 PolarHBondContact O-N 3.28Å; A695-A699 WeakPolarHBondContact O-CB 3.23Å; A695-A699 PolarHBondContact O-N 2.82Å
696	S	66.8	Low	62.2	Low	50 Å²	50	92.8 Å²	92.8	35%	0.35	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-38.2	174.3	-67.3	0	0	0	0	113	E692 E694 K700	E692-S696 WeakPolarHBondContact O-CB 3.41Å; E692-S696 PolarHBondContact O-N 3.01Å; E692-S696 PolarHBondContact O-OG 2.91Å; E694-S696 VanDerWaalsContact C-N 3.27Å; E694-S696 PolarHBondContact O-N 3.3Å; S696-K700 WeakPolarHBondContact O-CB 3.35Å; S696-K700 WeakPolarHBondContact O-CD 3.27Å; S696-K700 VanDerWaalsContact O-CG 3.24Å; S696-K700 WeakPolarHBondContact O-CG 3.5Å; S696-K700 PolarHBondContact O-N 2.9Å; S696-K700 VanDerWaalsContact O-N 3.13Å
697	K	70.8	Confident	59.6	Low	135 Å²	135	93.8 Å²	93.8	59%	0.587	51%	0.51	S	S	*	.	H	α-helix	trans	-68.3	-45.5	173.3	-72.8	162.9	-173.7	170.7	0	111	A693 E694 A699 K700 H701	A693-K697 WeakPolarHBondContact O-CD 3.24Å; A693-K697 WeakPolarHBondContact O-CG 3.37Å; A693-K697 PolarHBondContact O-N 2.92Å; A693-K697 VanDerWaalsContact O-N 3.08Å; E694-K697 WeakPolarHBondContact O-CB 3.42Å; E694-K697 PolarHBondContact O-N 3.44Å; E694-K697 VanDerWaalsContact O-N 3.08Å; K697-A699 VanDerWaalsContact C-N 3.33Å; K697-A699 PolarHBondContact O-N 2.82Å; K697-K700 PolarHBondContact O-N 3.18Å; K697-H701 PolarHBondContact O-CD2 2.93Å; K697-H701 PolarHBondContact O-N 3.13Å
698	A	60.9	Low	56.9	Low	28 Å²	28	98.1 Å²	98.1	23%	0.231	53%	0.531	C	S	.	.	H	α-helix	trans	-62	-38.5	178.7	0	0	0	0	0	112.5	Y663 E694 A695	Y663-A698 HydrophobicContact CE2-CB 4.11Å; E694-A698 WeakPolarHBondContact O-CB 3.39Å; E694-A698 PolarHBondContact O-N 2.96Å; A695-A698 PolarHBondContact O-N 3.28Å
699	A	54.8	Low	54.1	Low	65 Å²	65	107.4 Å²	107.4	54%	0.537	57%	0.565	S	S	.	*	H	α-helix	trans	-63.3	-51.5	172.4	0	0	0	0	0	111.5	A695 K697 H701 K702	A695-A699 WeakPolarHBondContact O-CB 3.23Å; A695-A699 PolarHBondContact O-N 2.82Å; K697-A699 VanDerWaalsContact C-N 3.33Å; K697-A699 PolarHBondContact O-N 2.82Å; A699-H701 VanDerWaalsContact C-N 3.29Å; A699-H701 PolarHBondContact O-N 3.41Å; A699-K702 PolarHBondContact O-N 3.33Å; A699-K702 VanDerWaalsContact O-N 3.13Å
700	K	53	Low	51.5	Low	161 Å²	161	109.8 Å²	109.8	70%	0.7	58%	0.576	S	S	*	*	H	α-helix	trans	-60.1	-35.4	-179.7	-73.9	170.3	-178.1	178.5	0	112.9	S696 K697 K702 T703	S696-K700 WeakPolarHBondContact O-CB 3.35Å; S696-K700 WeakPolarHBondContact O-CD 3.27Å; S696-K700 VanDerWaalsContact O-CG 3.24Å; S696-K700 WeakPolarHBondContact O-CG 3.5Å; S696-K700 PolarHBondContact O-N 2.9Å; S696-K700 VanDerWaalsContact O-N 3.13Å; K697-K700 PolarHBondContact O-N 3.18Å; K700-K702 PolarHBondContact O-N 3.39Å; K700-T703 PolarHBondContact O-OG1 2.92Å
701	H	50.7	Low	48.8	Very low	161 Å²	161	116.4 Å²	116.4	75%	0.745	60%	0.595	S	S	*	*	H	α-helix	trans	-69.6	-23.8	177.1	-90.7	-77.4	0	0	0	114.8	K697 A699	K697-H701 PolarHBondContact O-CD2 2.93Å; K697-H701 PolarHBondContact O-N 3.13Å; A699-H701 VanDerWaalsContact C-N 3.29Å; A699-H701 PolarHBondContact O-N 3.41Å
702	K	41.2	Very low	46.2	Very low	123 Å²	123	124.1 Å²	124.1	54%	0.535	63%	0.628	S	S	.	*	H	α-helix	trans	-82.2	-13.5	-179.4	-75.1	-164.7	172.5	-165.5	0	114.5	A699 K700 A704	A699-K702 PolarHBondContact O-N 3.33Å; A699-K702 VanDerWaalsContact O-N 3.13Å; K700-K702 PolarHBondContact O-N 3.39Å; K702-A704 PolarHBondContact O-N 2.99Å; K702-A704 VanDerWaalsContact O-N 3.08Å
703	T	34.8	Very low	43.9	Very low	125 Å²	125	127.6 Å²	127.6	77%	0.767	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-10.8	-177	-14.8	0	0	0	0	115.3	K700	K700-T703 PolarHBondContact O-OG1 2.92Å
704	A	31.7	Very low	41.5	Very low	95 Å²	95	130 Å²	130	79%	0.785	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-5.3	-173.9	0	0	0	0	0	115.2	K702	K702-A704 PolarHBondContact O-N 2.99Å; K702-A704 VanDerWaalsContact O-N 3.08Å
705	Q	29.6	Very low	39.3	Very low	152 Å²	152	133.8 Å²	133.8	71%	0.71	68%	0.679	S	S	*	*			trans	-111.4	98	-176.2	-151.4	172	26.4	0	0	111.5	V707	Q705-V707 HydrophobicContact CB-CG2 4.5Å; Q705-V707 HydrophobicContact CG-CG2 4.07Å; Q705-V707 PolarHBondContact O-N 2.82Å
706	S	26.3	Very low	37.4	Very low	120 Å²	120	135.8 Å²	135.8	84%	0.839	69%	0.691	S	S	*	*			trans	-73.4	58.1	178.2	47.1	0	0	0	0	112.7	K708	S706-K708 PolarHBondContact O-N 3.23Å
707	V	29.4	Very low	35.4	Very low	117 Å²	117	141 Å²	141	71%	0.709	72%	0.715	S	S	*	*			trans	-57.7	125.8	173.5	-177.8	0	0	0	0	108.7	Q705 R709	Q705-V707 HydrophobicContact CB-CG2 4.5Å; Q705-V707 HydrophobicContact CG-CG2 4.07Å; Q705-V707 PolarHBondContact O-N 2.82Å; V707-R709 PolarHBondContact O-N 3.01Å
708	K	27.2	Very low	33.3	Very low	182 Å²	182	144.1 Å²	144.1	79%	0.791	73%	0.732	S	S	*	*			trans	-58.2	133.5	-169.8	-69.8	176.5	-179.7	173.5	0	110.9	S706 E710	S706-K708 PolarHBondContact O-N 3.23Å; K708-E710 PolarHBondContact O-N 2.98Å
709	R	26.6	Very low	31.7	Very low	245 Å²	245	146.9 Å²	146.9	93%	0.925	75%	0.754	S	S	*	*			trans	-67.7	78.3	170.1	-170.4	180	-165.6	157.6	3.6	109.4	V707 R711	V707-R709 PolarHBondContact O-N 3.01Å; R709-R711 PolarHBondContact O-N 2.76Å; R709-R711 VanDerWaalsContact O-N 3.1Å
710	E	26.4	Very low	30.6	Very low	151 Å²	151	151 Å²	151	71%	0.706	76%	0.763	S	S	*	*			trans	-61.9	114.1	177.7	-76	-161.3	146.4	0	0	110.1	K708 F712	K708-E710 PolarHBondContact O-N 2.98Å; E710-F712 VanDerWaalsContact C-N 3.3Å; E710-F712 HydrophobicContact CB-CE2 4.44Å; E710-F712 PolarHBondContact O-N 2.84Å
711	R	25.4	Very low	29.3	Very low	225 Å²	225	147.7 Å²	147.7	85%	0.849	75%	0.752	S	S	*	*			trans	-71.6	87.3	169.3	-67.8	176.5	174.7	177.1	-3	108.5	R709 Y713	R709-R711 PolarHBondContact O-N 2.76Å; R709-R711 VanDerWaalsContact O-N 3.1Å; R711-Y713 PolarHBondContact O-N 3.27Å
712	F	26.4	Very low	28.3	Very low	180 Å²	180	145.8 Å²	145.8	79%	0.789	75%	0.747	S	S	*	*			trans	-66.6	128.5	147.1	-78.5	-80.7	0	0	0	107.6	E710 S714	E710-F712 VanDerWaalsContact C-N 3.3Å; E710-F712 HydrophobicContact CB-CE2 4.44Å; E710-F712 PolarHBondContact O-N 2.84Å; F712-S714 PolarHBondContact O-N 2.99Å
713	Y	25.5	Very low	27.7	Very low	212 Å²	212	149.3 Å²	149.3	83%	0.831	76%	0.757	S	S	*	*			trans	-66.9	132	-155.6	-88.1	-108.8	0	0	0	112.5	R711 V715	R711-Y713 PolarHBondContact O-N 3.27Å; Y713-V715 PolarHBondContact O-N 3.21Å; Y713-V715 VanDerWaalsContact O-N 3.15Å
714	S	25.1	Very low	27.2	Very low	92 Å²	92	147.3 Å²	147.3	64%	0.643	75%	0.747	S	S	*	*			trans	-56.3	114.8	150.8	-50.6	0	0	0	0	108.7	F712 S716	F712-S714 PolarHBondContact O-N 2.99Å; S714-S716 VanDerWaalsContact CB-OG 3.25Å; S714-S716 WeakPolarHBondContact CB-OG 3.12Å; S714-S716 PolarHBondContact O-N 2.92Å
715	V	26.5	Very low	27.1	Very low	156 Å²	156	150.5 Å²	150.5	95%	0.945	75%	0.745	S	S	*	*			trans	-76	80	155.8	-179.7	0	0	0	0	106.2	Y713	Y713-V715 PolarHBondContact O-N 3.21Å; Y713-V715 VanDerWaalsContact O-N 3.15Å
716	S	25.3	Very low	27.1	Very low	76 Å²	76	149.7 Å²	149.7	53%	0.531	75%	0.746	S	S	.	*			trans	-123.7	121.6	-175.3	57.2	0	0	0	0	111.9	S714	S714-S716 VanDerWaalsContact CB-OG 3.25Å; S714-S716 WeakPolarHBondContact CB-OG 3.12Å; S714-S716 PolarHBondContact O-N 2.92Å
717	N	25.5	Very low	27.2	Very low	159 Å²	159	148.2 Å²	148.2	85%	0.85	74%	0.736	S	S	*	*			trans	62.4	72.9	148.1	-55.7	-11.6	0	0	0	118.8
718	E	27.4	Very low	27.3	Very low	202 Å²	202	149.4 Å²	149.4	94%	0.944	74%	0.737	S	S	*	*			trans	-136.2	131.2	135	-73.8	-176.7	169.5	0	0	106.7
719	A	27.4	Very low	27.4	Very low	85 Å²	85	148 Å²	148	70%	0.702	73%	0.734	S	S	*	*			cis	-122.6	146.9	-3.8	0	0	0	0	0	108.6
720	E	30.3	Very low	27.5	Very low	153 Å²	153	142 Å²	142	72%	0.715	72%	0.72	S	S	*	*				39.1	111.4	83	-57.7	-161.9	132.7	0	0	112.6	L722	E720-L722 HydrophobicContact CB-CD1 4.42Å; E720-L722 HydrophobicContact CB-CG 4.3Å
721	N	26.2	Very low	27.7	Very low	91 Å²	91	140.3 Å²	140.3	49%	0.487	72%	0.72	S	S	.	*			cis	69.2	33.4	23	-143.6	13.7	0	0	0	114.2	K753	N721-K753 PolarHBondContact ND2-O 3.26Å
722	L	29.7	Very low	28	Very low	120 Å²	120	135.9 Å²	135.9	63%	0.628	72%	0.718	S	S	*	*			trans	-128.2	96.8	172.6	-80.5	175.5	0	0	0	113.8	E720	E720-L722 HydrophobicContact CB-CD1 4.42Å; E720-L722 HydrophobicContact CB-CG 4.3Å
723	R	28	Very low	28.3	Very low	198 Å²	198	138 Å²	138	75%	0.747	72%	0.721	S	S	*	*			trans	78.7	85.9	132.6	-157.4	176.1	-161.3	168.9	6.5	120	E751	R723-E751 WeakPolarHBondContact CA-OE1 3.49Å; R723-E751 PolarHBondContact N-OE1 3.45Å
724	C	25.1	Very low	28.6	Very low	82 Å²	82	131 Å²	131	55%	0.554	71%	0.713	S	S	*	*	S	Bend	trans	-38.8	145.9	134.4	-97.5	0	0	0	0	112.2	E751	C724-E751 WeakPolarHBondContact CA-OE2 3.27Å; C724-E751 WeakPolarHBondContact CB-OE2 3.37Å; C724-E751 PolarHBondContact N-OE1 3.23Å; C724-E751 PolarHBondContact N-OE2 2.87Å; C724-E751 PolarHBondContact SG-OE2 2.86Å
725	Q	29.1	Very low	29	Very low	162 Å²	162	133.5 Å²	133.5	76%	0.757	72%	0.72	S	S	*	*			trans	63.5	92.6	177.7	-61.2	-173.6	-19.6	0	0	115.4
726	N	30.6	Very low	29.4	Very low	135 Å²	135	131.4 Å²	131.4	72%	0.722	71%	0.712	S	S	*	*				174.1	109.3	103.8	-85.9	-13.5	0	0	0	108.7
727	S	29.2	Very low	29.7	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	72%	0.724	S	S	*	*				95.3	124.9	66.3	70.3	0	0	0	0	111.9
728	L	29.5	Very low	30.2	Very low	141 Å²	141	129.9 Å²	129.9	74%	0.738	71%	0.713	S	S	*	*			trans	66	129.8	163.7	-87.9	67.7	0	0	0	118.6
729	Q	29.6	Very low	30.6	Very low	154 Å²	154	127.2 Å²	127.2	72%	0.72	71%	0.706	S	S	*	*			trans	72.5	138.9	138.6	-66.3	177.3	-4.9	0	0	117.7
730	N	30.3	Very low	30.9	Very low	119 Å²	119	131.3 Å²	131.3	64%	0.636	71%	0.71	S	S	*	*			cis	-158.1	163.2	3.3	-124.6	-16.9	0	0	0	111.6
731	T	30.4	Very low	31.1	Very low	115 Å²	115	130.9 Å²	130.9	71%	0.706	71%	0.713	S	S	*	*			trans	50.8	130.2	147.3	54.3	0	0	0	0	119.7
732	T	31.2	Very low	31.4	Very low	131 Å²	131	133.4 Å²	133.4	80%	0.804	73%	0.725	S	S	*	*			cis	-171.2	-175.2	-5.7	-13.9	0	0	0	0	105.6
733	R	31.6	Very low	31.7	Very low	225 Å²	225	134.4 Å²	134.4	85%	0.849	73%	0.73	S	S	*	*			cis	-155.6	118.1	6.2	-173.6	176.8	-172.7	163.8	1.6	111.6
734	G	33.1	Very low	31.8	Very low	65 Å²	65	131.3 Å²	131.3	67%	0.67	73%	0.729	S	S	*	*			trans	86	157.1	146	0	0	0	0	0	118.7
735	N	33.9	Very low	32.1	Very low	145 Å²	145	136.6 Å²	136.6	78%	0.775	74%	0.742	S	S	*	*			cis	-150	150.4	-4.4	-87	-22.6	0	0	0	110.3
736	S	33.1	Very low	32.2	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	75%	0.746	S	S	*	*			trans	42.4	138.6	148.9	58.9	0	0	0	0	120.7
737	S	32.9	Very low	32.4	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	75%	0.749	S	S	*	*			cis	-173.8	168	-6	51.9	0	0	0	0	105.8
738	S	36.3	Very low	32.7	Very low	88 Å²	88	136.6 Å²	136.6	62%	0.615	75%	0.748	S	S	*	*			cis	-155.8	151.4	13.5	45.4	0	0	0	0	109.2
739	D	34.8	Very low	32.7	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	75%	0.748	S	S	*	*				40.4	130	126.2	-45.3	-28.8	0	0	0	119
740	E	34.6	Very low	32.8	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	76%	0.757	S	S	*	*			cis	-147.8	132	8.2	-103.7	169.3	-174.1	0	0	108.3
741	N	33.2	Very low	32.8	Very low	144 Å²	144	140.1 Å²	140.1	77%	0.77	75%	0.745	S	S	*	*				89.5	150.5	79.5	-121.6	-23	0	0	0	115.9
742	I	33.4	Very low	32.7	Very low	143 Å²	143	141 Å²	141	73%	0.733	75%	0.745	S	S	*	*			trans	83.8	96.6	159	-65.8	165.9	0	0	0	120.2
743	L	35.6	Very low	32.8	Very low	141 Å²	141	143.2 Å²	143.2	74%	0.738	74%	0.743	S	S	*	*			trans	75.8	89	136.4	-60.8	176.5	0	0	0	123.2
744	N	31	Very low	32.8	Very low	134 Å²	134	139.9 Å²	139.9	72%	0.717	74%	0.742	S	S	*	*				99.9	132.2	110.6	-87.8	-9.6	0	0	0	123.6
745	K	29.8	Very low	32.8	Very low	192 Å²	192	148.4 Å²	148.4	84%	0.835	75%	0.754	S	S	*	*			trans	75.9	48.6	152.8	-67.2	-174.4	177.9	-178.3	0	120.3
746	I	32.7	Very low	32.4	Very low	163 Å²	163	152.9 Å²	152.9	84%	0.836	76%	0.76	S	S	*	*			trans	-130.8	101.2	146.9	-56.9	-178.4	0	0	0	110.4	E748	I746-E748 HydrophobicContact CG2-CG 4.42Å
747	A	33.3	Very low	32.1	Very low	97 Å²	97	151.9 Å²	151.9	80%	0.802	75%	0.752	S	S	*	*			trans	-171.2	69.5	169.6	0	0	0	0	0	107.2
748	E	35.9	Very low	31.8	Very low	128 Å²	128	154.2 Å²	154.2	60%	0.598	75%	0.75	S	S	*	*				47.8	102.2	81.1	-82.8	-107.5	121.5	0	0	114.2	I746	I746-E748 HydrophobicContact CG2-CG 4.42Å
749	R	30.8	Very low	31.3	Very low	198 Å²	198	154.8 Å²	154.8	75%	0.747	75%	0.754	S	S	*	*			trans	62.6	87.9	143.7	-59	174.3	168.9	132.7	-1.4	119.1
750	K	30.8	Very low	31	Very low	206 Å²	206	154.1 Å²	154.1	90%	0.896	76%	0.755	S	S	*	*				168.9	93.4	105.5	-92.2	177.7	176.2	-175.7	0	111.3
751	E	30.6	Very low	30.7	Very low	84 Å²	84	151 Å²	151	39%	0.393	75%	0.748	S	S	.	*			trans	-168.8	173.8	159.8	-126.1	171.3	-148.6	0	0	115.2	R723 C724	R723-E751 WeakPolarHBondContact CA-OE1 3.49Å; R723-E751 PolarHBondContact N-OE1 3.45Å; C724-E751 WeakPolarHBondContact CA-OE2 3.27Å; C724-E751 WeakPolarHBondContact CB-OE2 3.37Å; C724-E751 PolarHBondContact N-OE1 3.23Å; C724-E751 PolarHBondContact N-OE2 2.87Å; C724-E751 PolarHBondContact SG-OE2 2.86Å
752	L	28.8	Very low	30.3	Very low	133 Å²	133	150.1 Å²	150.1	70%	0.696	74%	0.743	S	S	*	*			trans	62.4	86.2	165.7	-67.9	164.7	0	0	0	116.5
753	K	33.3	Very low	30.1	Very low	177 Å²	177	152.4 Å²	152.4	77%	0.77	75%	0.748	S	S	*	*			trans	-161.3	119.9	144.7	-109.5	153.6	-172.2	174.1	0	111.7	N721	N721-K753 PolarHBondContact ND2-O 3.26Å
754	N	30.9	Very low	29.6	Very low	155 Å²	155	154.7 Å²	154.7	83%	0.829	75%	0.752	S	S	*	*			trans	144.9	69.3	152.7	-77.5	-7.7	0	0	0	113.4
755	R	33.6	Very low	29.7	Very low	245 Å²	245	153 Å²	153	93%	0.925	75%	0.747	S	S	*	*			trans	-160.5	113.8	152.6	-111.4	171.9	-165.3	-156.5	3.8	111.2
756	R	26.3	Very low	29.5	Very low	239 Å²	239	150.2 Å²	150.2	90%	0.902	75%	0.746	S	S	*	*			trans	52.7	152.2	147.5	-110.4	179.7	-175.4	169.1	1	121.7
757	C	25.5	Very low	29.5	Very low	90 Å²	90	148 Å²	148	61%	0.608	74%	0.74	S	S	*	*			trans	87.4	126	142	-75.7	0	0	0	0	122.4
758	H	27.7	Very low	29.4	Very low	163 Å²	163	152.5 Å²	152.5	76%	0.755	74%	0.742	S	S	*	*			trans	68.9	105.9	141.3	-54.7	-47.1	0	0	0	122.3
759	S	24.5	Very low	29	Very low	101 Å²	101	153.1 Å²	153.1	71%	0.706	76%	0.757	S	S	*	*				29.3	119.3	126.8	57	0	0	0	0	121.3
760	V	29.9	Very low	28.9	Very low	132 Å²	132	147.8 Å²	147.8	80%	0.8	75%	0.75	S	S	*	*			trans	-143.4	98.6	146.6	-175.2	0	0	0	0	105.9
761	T	27.7	Very low	29.1	Very low	105 Å²	105	144.9 Å²	144.9	64%	0.644	74%	0.744	S	S	*	*				48.4	123.2	91.9	42	0	0	0	0	117.4
762	D	25.4	Very low	29.2	Very low	126 Å²	126	149.3 Å²	149.3	67%	0.674	77%	0.769	S	S	*	*			trans	33.8	119.4	142.8	-46.7	-40.7	0	0	0	121
763	F	28.5	Very low	29.5	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.842	77%	0.773	S	S	*	*			trans	-134.1	81.1	144.2	-102.6	-78.9	0	0	0	110.6	V765	F763-V765 HydrophobicContact CB-CG2 4.42Å; F763-V765 HydrophobicContact CD1-CG2 3.86Å; F763-V765 PolarHBondContact O-N 3.19Å
764	F	25.6	Very low	29.3	Very low	188 Å²	188	149.3 Å²	149.3	83%	0.825	77%	0.773	S	S	*	*			trans	-63.7	108.4	151.4	-87.8	-92.4	0	0	0	107.8
765	V	31.8	Very low	29.3	Very low	99 Å²	99	148.4 Å²	148.4	60%	0.6	77%	0.773	S	S	*	*			trans	-101.1	96.6	168.9	179.9	0	0	0	0	108.7	F763 T767	F763-V765 HydrophobicContact CB-CG2 4.42Å; F763-V765 HydrophobicContact CD1-CG2 3.86Å; F763-V765 PolarHBondContact O-N 3.19Å; V765-T767 VanDerWaalsContact C-N 3.3Å; V765-T767 HydrophobicContact CG1-CG2 4.02Å; V765-T767 PolarHBondContact O-N 2.97Å
766	T	26.9	Very low	29.3	Very low	134 Å²	134	139.8 Å²	139.8	82%	0.822	75%	0.75	S	S	*	*			trans	-76.6	74.3	175.9	37.5	0	0	0	0	111.5
767	T	32.7	Very low	29.9	Very low	116 Å²	116	133.3 Å²	133.3	71%	0.712	74%	0.742	S	S	*	*			trans	-101	135.7	166.2	42.7	0	0	0	0	110.9	V765	V765-T767 VanDerWaalsContact C-N 3.3Å; V765-T767 HydrophobicContact CG1-CG2 4.02Å; V765-T767 PolarHBondContact O-N 2.97Å
768	K	29.8	Very low	30.3	Very low	192 Å²	192	135.2 Å²	135.2	84%	0.835	75%	0.745	S	S	*	*			trans	-71.4	147	-158.6	-63.5	178.7	179.7	179.2	0	113.9	S770	K768-S770 PolarHBondContact O-N 3.41Å; K768-S770 VanDerWaalsContact O-N 3.13Å
769	P	28.6	Very low	30.6	Very low	141 Å²	141	131.9 Å²	131.9	92%	0.916	73%	0.73	S	S	*	*	S	Bend	trans	-83.7	82.4	177.2	34.5	-34.8	0	0	0	112
770	S	28.9	Very low	31.1	Very low	86 Å²	86	130.2 Å²	130.2	60%	0.601	72%	0.718	S	S	*	*			trans	-148	160.9	160.1	67.1	0	0	0	0	109.6	K768	K768-S770 PolarHBondContact O-N 3.41Å; K768-S770 VanDerWaalsContact O-N 3.13Å
771	D	33.5	Very low	31.5	Very low	144 Å²	144	126.5 Å²	126.5	77%	0.77	70%	0.698	S	S	*	*	S	Bend	trans	61	72.2	167.4	-46.3	-49.8	0	0	0	117
772	L	34	Very low	31.9	Very low	177 Å²	177	127.8 Å²	127.8	93%	0.927	70%	0.697	S	S	*	*			trans	-168.3	80.9	133.6	-104.2	162.8	0	0	0	111.1
773	Q	33.8	Very low	32.4	Very low	167 Å²	167	128.3 Å²	128.3	78%	0.78	69%	0.689	S	S	*	*			trans	-68.8	153.8	168.2	-70.4	-175.2	-11.6	0	0	111.5
774	N	30.6	Very low	33.2	Very low	143 Å²	143	122.7 Å²	122.7	77%	0.765	67%	0.674	S	S	*	*			trans	56.1	83.5	152.9	-60.4	-27.1	0	0	0	118.2
775	V	29.4	Very low	34	Very low	137 Å²	137	116.7 Å²	116.7	83%	0.83	65%	0.65	S	S	*	*	S	Bend		-175.6	150.5	123.5	140.6	0	0	0	0	111.3
776	S	33.5	Very low	34.6	Very low	63 Å²	63	118 Å²	118	44%	0.441	65%	0.648	S	S	.	*			trans	76.5	14.4	163.3	79.8	0	0	0	0	121.3	L778 E779 S780	S776-L778 PolarHBondContact O-N 3.35Å; S776-E779 PolarHBondContact O-N 2.8Å; S776-S780 PolarHBondContact O-N 2.78Å; S776-S780 PolarHBondContact O-OG 2.75Å
777	S	38.8	Very low	35.3	Very low	103 Å²	103	120.3 Å²	120.3	72%	0.72	64%	0.643	S	S	*	*	H	α-helix	trans	-54	-28.7	176.8	57	0	0	0	0	115.3	S780 S781	S777-S780 PolarHBondContact O-OG 2.99Å; S777-S780 VanDerWaalsContact O-OG 3.05Å; S777-S781 PolarHBondContact O-N 3.15Å
778	L	34.6	Very low	35.7	Very low	130 Å²	130	117.3 Å²	117.3	68%	0.681	63%	0.626	S	S	*	*	H	α-helix	trans	-81.3	-32	176.2	-163.5	67.5	0	0	0	113.2	S776 Q782	S776-L778 PolarHBondContact O-N 3.35Å; L778-Q782 PolarHBondContact O-N 3.42Å
779	E	34.6	Very low	36.4	Very low	94 Å²	94	108.9 Å²	108.9	44%	0.439	59%	0.591	S	S	.	*	H	α-helix	trans	-76.4	-35.6	174.3	-71.4	-151.8	128.4	0	0	112	S776 S781 Q782 R783	S776-E779 PolarHBondContact O-N 2.8Å; E779-S781 VanDerWaalsContact C-N 3.31Å; E779-S781 PolarHBondContact O-N 3.44Å; E779-Q782 PolarHBondContact O-N 3.12Å; E779-R783 WeakPolarHBondContact O-CB 3.37Å; E779-R783 WeakPolarHBondContact O-CG 3.31Å; E779-R783 PolarHBondContact O-N 2.99Å; E779-R783 IonicContact OE1-CZ 3.63Å; E779-R783 IonicContact OE1-NH2 2.7Å; E779-R783 PolarHBondContact OE1-NH2 3.28Å; E779-R783 IonicContact OE2-CZ 2.97Å; E779-R783 IonicContact OE2-NH1 3.29Å; E779-R783 PolarHBondContact OE2-NH1 3Å; E779-R783 IonicContact OE2-NH2 3.37Å; E779-R783 PolarHBondContact OE2-NH2 2.86Å
780	S	35.6	Very low	37.3	Very low	65 Å²	65	106.3 Å²	106.3	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-63.4	-39.5	175.5	64.4	0	0	0	0	110.9	S776 S777 R783 S784	S776-S780 PolarHBondContact O-N 2.78Å; S776-S780 PolarHBondContact O-OG 2.75Å; S777-S780 PolarHBondContact O-OG 2.99Å; S777-S780 VanDerWaalsContact O-OG 3.05Å; S780-R783 PolarHBondContact O-N 2.75Å; S780-S784 VanDerWaalsContact O-CB 3.23Å; S780-S784 WeakPolarHBondContact O-CB 3.25Å; S780-S784 PolarHBondContact O-N 3.29Å; S780-S784 PolarHBondContact O-OG 2.75Å; S780-S784 VanDerWaalsContact O-OG 3.08Å
781	S	36.6	Very low	38.1	Very low	55 Å²	55	107 Å²	107	39%	0.385	56%	0.563	S	S	.	*	H	α-helix	trans	-58.1	-48.4	170.3	178.1	0	0	0	0	112.9	S777 E779 S784 L785	S777-S781 PolarHBondContact O-N 3.15Å; E779-S781 VanDerWaalsContact C-N 3.31Å; E779-S781 PolarHBondContact O-N 3.44Å; S781-S784 PolarHBondContact O-OG 2.85Å; S781-S784 VanDerWaalsContact O-OG 3.12Å; S781-L785 WeakPolarHBondContact O-CB 3.22Å; S781-L785 PolarHBondContact O-N 2.82Å; S781-L785 VanDerWaalsContact O-N 3.07Å
782	Q	37	Very low	38.4	Very low	131 Å²	131	102.6 Å²	102.6	61%	0.612	54%	0.538	S	S	*	.	H	α-helix	trans	-69.9	-36.5	179.7	-70.5	-175.9	0.4	0	0	112.8	L778 E779 K786	L778-Q782 PolarHBondContact O-N 3.42Å; E779-Q782 PolarHBondContact O-N 3.12Å; Q782-K786 VanDerWaalsContact O-CB 3.23Å; Q782-K786 WeakPolarHBondContact O-CB 3.35Å; Q782-K786 PolarHBondContact O-N 3.1Å; Q782-K786 VanDerWaalsContact O-N 3.09Å
783	R	35.7	Very low	38.7	Very low	138 Å²	138	96.3 Å²	96.3	52%	0.521	51%	0.507	S	S	.	.	H	α-helix	trans	-71.4	-42.8	176.2	-71.4	-179.7	-175.7	125.2	15	111.5	E779 S780 K786 Y787	E779-R783 WeakPolarHBondContact O-CB 3.37Å; E779-R783 WeakPolarHBondContact O-CG 3.31Å; E779-R783 PolarHBondContact O-N 2.99Å; E779-R783 IonicContact OE1-CZ 3.63Å; E779-R783 IonicContact OE1-NH2 2.7Å; E779-R783 PolarHBondContact OE1-NH2 3.28Å; E779-R783 IonicContact OE2-CZ 2.97Å; E779-R783 IonicContact OE2-NH1 3.29Å; E779-R783 PolarHBondContact OE2-NH1 3Å; E779-R783 IonicContact OE2-NH2 3.37Å; E779-R783 PolarHBondContact OE2-NH2 2.86Å; S780-R783 PolarHBondContact O-N 2.75Å; R783-K786 PolarHBondContact O-N 2.67Å; R783-Y787 WeakPolarHBondContact O-CD2 3.34Å; R783-Y787 PolarHBondContact O-N 3.13Å
784	S	46.1	Very low	39.1	Very low	73 Å²	73	95.1 Å²	95.1	51%	0.51	50%	0.499	S	S	.	.	H	α-helix	trans	-64.6	-42.9	178.5	69.8	0	0	0	0	111.6	S780 S781 Y787 S788	S780-S784 VanDerWaalsContact O-CB 3.23Å; S780-S784 WeakPolarHBondContact O-CB 3.25Å; S780-S784 PolarHBondContact O-N 3.29Å; S780-S784 PolarHBondContact O-OG 2.75Å; S780-S784 VanDerWaalsContact O-OG 3.08Å; S781-S784 PolarHBondContact O-OG 2.85Å; S781-S784 VanDerWaalsContact O-OG 3.12Å; S784-Y787 PolarHBondContact O-N 2.91Å; S784-S788 WeakPolarHBondContact O-CB 3.09Å; S784-S788 PolarHBondContact O-N 3.4Å
785	L	42.3	Very low	39.4	Very low	63 Å²	63	95 Å²	95	33%	0.33	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-41.3	176.7	-157.9	157.7	0	0	0	111	S781 S788 C789	S781-L785 WeakPolarHBondContact O-CB 3.22Å; S781-L785 PolarHBondContact O-N 2.82Å; S781-L785 VanDerWaalsContact O-N 3.07Å; L785-S788 PolarHBondContact O-N 3.5Å; L785-C789 WeakPolarHBondContact O-CB 3.23Å; L785-C789 PolarHBondContact O-N 2.91Å; L785-C789 PolarHBondContact O-SG 2.87Å
786	K	44.4	Very low	40	Very low	127 Å²	127	90.1 Å²	90.1	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-63.9	-42.6	175.5	-175.1	169.1	-175	168.8	0	113.2	Q782 R783 L790	Q782-K786 VanDerWaalsContact O-CB 3.23Å; Q782-K786 WeakPolarHBondContact O-CB 3.35Å; Q782-K786 PolarHBondContact O-N 3.1Å; Q782-K786 VanDerWaalsContact O-N 3.09Å; R783-K786 PolarHBondContact O-N 2.67Å; K786-L790 HydrophobicContact CG-CD1 3.94Å; K786-L790 VanDerWaalsContact O-CB 3.24Å; K786-L790 WeakPolarHBondContact O-CB 3.35Å; K786-L790 VanDerWaalsContact O-CG 3.32Å; K786-L790 WeakPolarHBondContact O-CG 3.41Å; K786-L790 PolarHBondContact O-N 3.33Å
787	Y	41.8	Very low	40.5	Very low	182 Å²	182	93.1 Å²	93.1	71%	0.714	46%	0.464	S	S	*	.	H	α-helix	trans	-69.9	-44.9	175.3	-92	-92.2	0	0	0	111.7	R783 S784 L790 E791	R783-Y787 WeakPolarHBondContact O-CD2 3.34Å; R783-Y787 PolarHBondContact O-N 3.13Å; S784-Y787 PolarHBondContact O-N 2.91Å; Y787-L790 PolarHBondContact O-N 3.29Å; Y787-E791 VanDerWaalsContact O-CB 3.28Å; Y787-E791 WeakPolarHBondContact O-CB 3.29Å; Y787-E791 PolarHBondContact O-N 3.17Å
788	S	40.8	Very low	40.6	Very low	53 Å²	53	95.1 Å²	95.1	37%	0.371	47%	0.466	S	S	.	.	H	α-helix	trans	-57.4	-52.7	176.9	-174.2	0	0	0	0	111	S784 L785 E791 Q792	S784-S788 WeakPolarHBondContact O-CB 3.09Å; S784-S788 PolarHBondContact O-N 3.4Å; L785-S788 PolarHBondContact O-N 3.5Å; S788-E791 PolarHBondContact O-N 2.71Å; S788-Q792 WeakPolarHBondContact O-CB 3.26Å; S788-Q792 WeakPolarHBondContact O-CG 3.45Å; S788-Q792 PolarHBondContact O-N 2.87Å; S788-Q792 PolarHBondContact OG-NE2 2.93Å
789	C	44.2	Very low	40.8	Very low	14 Å²	14	98.7 Å²	98.7	10%	0.095	47%	0.47	C	S	.	.	H	α-helix	trans	-67.2	-38.1	178.6	-67.7	0	0	0	0	113.2	L785 V793 L828	L785-C789 WeakPolarHBondContact O-CB 3.23Å; L785-C789 PolarHBondContact O-N 2.91Å; L785-C789 PolarHBondContact O-SG 2.87Å; C789-V793 VanDerWaalsContact O-CB 3.28Å; C789-V793 WeakPolarHBondContact O-CB 3.43Å; C789-V793 WeakPolarHBondContact O-CG2 3.42Å; C789-V793 PolarHBondContact O-N 2.93Å; C789-L828 HydrophobicContact CB-CD1 3.87Å
790	L	48	Very low	41.2	Very low	88 Å²	88	100 Å²	100	46%	0.461	48%	0.48	S	S	.	.	H	α-helix	trans	-70.7	-35.8	176.9	-79	170.1	0	0	0	113.1	K786 Y787 K794	K786-L790 HydrophobicContact CG-CD1 3.94Å; K786-L790 VanDerWaalsContact O-CB 3.24Å; K786-L790 WeakPolarHBondContact O-CB 3.35Å; K786-L790 VanDerWaalsContact O-CG 3.32Å; K786-L790 WeakPolarHBondContact O-CG 3.41Å; K786-L790 PolarHBondContact O-N 3.33Å; Y787-L790 PolarHBondContact O-N 3.29Å; L790-K794 WeakPolarHBondContact O-CG 3.45Å; L790-K794 PolarHBondContact O-N 3.43Å; L790-K794 VanDerWaalsContact O-N 3.13Å
791	E	44.7	Very low	41.4	Very low	100 Å²	100	105 Å²	105	47%	0.467	49%	0.494	S	S	.	.	H	α-helix	trans	-76.2	-39.7	176.8	-153.3	-163.7	175.8	0	0	111.2	Y787 S788 K794 R795	Y787-E791 VanDerWaalsContact O-CB 3.28Å; Y787-E791 WeakPolarHBondContact O-CB 3.29Å; Y787-E791 PolarHBondContact O-N 3.17Å; S788-E791 PolarHBondContact O-N 2.71Å; E791-K794 PolarHBondContact O-N 3.04Å; E791-R795 VanDerWaalsContact CD-CZ 3.43Å; E791-R795 VanDerWaalsContact CD-NE 3.33Å; E791-R795 WeakPolarHBondContact O-CB 3.37Å; E791-R795 WeakPolarHBondContact O-CG 3.42Å; E791-R795 PolarHBondContact O-N 3.08Å; E791-R795 IonicContact OE1-CZ 2.75Å; E791-R795 VanDerWaalsContact OE1-CZ 3.27Å; E791-R795 IonicContact OE1-NE 2.99Å; E791-R795 PolarHBondContact OE1-NE 3.16Å; E791-R795 VanDerWaalsContact OE1-NE 3.14Å; E791-R795 IonicContact OE1-NH2 2.66Å; E791-R795 PolarHBondContact OE1-NH2 3Å; E791-R795 IonicContact OE2-CZ 2.75Å; E791-R795 IonicContact OE2-NE 3.18Å; E791-R795 IonicContact OE2-NH2 3.7Å; E791-R795 PolarHBondContact OE2-NH2 2.99Å
792	Q	39.4	Very low	41.9	Very low	51 Å²	51	105.2 Å²	105.2	24%	0.238	49%	0.49	C	S	.	.	H	α-helix	trans	-58.9	-52.1	169.6	-73.7	176.6	9.8	0	0	110.5	S788 K794 R795 L796	S788-Q792 WeakPolarHBondContact O-CB 3.26Å; S788-Q792 WeakPolarHBondContact O-CG 3.45Å; S788-Q792 PolarHBondContact O-N 2.87Å; S788-Q792 PolarHBondContact OG-NE2 2.93Å; Q792-K794 VanDerWaalsContact C-N 3.26Å; Q792-K794 PolarHBondContact O-N 3.44Å; Q792-R795 CarbonylContact O-C 3.59Å; Q792-R795 WeakPolarHBondContact O-CA 3.37Å; Q792-R795 PolarHBondContact O-N 3.11Å; Q792-L796 HydrophobicContact CB-CD1 4.26Å; Q792-L796 WeakPolarHBondContact O-CB 3.27Å; Q792-L796 WeakPolarHBondContact O-CD1 3.19Å; Q792-L796 WeakPolarHBondContact O-CG 3.16Å; Q792-L796 PolarHBondContact O-N 2.7Å
793	V	41.1	Very low	42.2	Very low	46 Å²	46	104.3 Å²	104.3	28%	0.279	49%	0.494	S	S	.	.	H	α-helix	trans	-56.1	-39.4	177.9	167.7	0	0	0	0	111.9	C789 L796 Q797	C789-V793 VanDerWaalsContact O-CB 3.28Å; C789-V793 WeakPolarHBondContact O-CB 3.43Å; C789-V793 WeakPolarHBondContact O-CG2 3.42Å; C789-V793 PolarHBondContact O-N 2.93Å; V793-L796 PolarHBondContact O-N 2.7Å; V793-Q797 WeakPolarHBondContact O-CB 3.38Å; V793-Q797 PolarHBondContact O-N 2.86Å
794	K	43	Very low	43.3	Very low	141 Å²	141	99.4 Å²	99.4	61%	0.613	48%	0.477	S	S	*	.	H	α-helix	trans	-67.3	-37.3	173	-75.4	176.9	177.1	-175.6	0	114	L790 E791 Q792	L790-K794 WeakPolarHBondContact O-CG 3.45Å; L790-K794 PolarHBondContact O-N 3.43Å; L790-K794 VanDerWaalsContact O-N 3.13Å; E791-K794 PolarHBondContact O-N 3.04Å; Q792-K794 VanDerWaalsContact C-N 3.26Å; Q792-K794 PolarHBondContact O-N 3.44Å
795	R	35.4	Very low	44	Very low	141 Å²	141	98 Å²	98	53%	0.532	47%	0.466	S	S	.	.	H	α-helix	trans	-72.3	-32.1	175.6	-69.6	165.8	179.3	-164.5	2.1	112	E791 Q792 L798	E791-R795 VanDerWaalsContact CD-CZ 3.43Å; E791-R795 VanDerWaalsContact CD-NE 3.33Å; E791-R795 WeakPolarHBondContact O-CB 3.37Å; E791-R795 WeakPolarHBondContact O-CG 3.42Å; E791-R795 PolarHBondContact O-N 3.08Å; E791-R795 IonicContact OE1-CZ 2.75Å; E791-R795 VanDerWaalsContact OE1-CZ 3.27Å; E791-R795 IonicContact OE1-NE 2.99Å; E791-R795 PolarHBondContact OE1-NE 3.16Å; E791-R795 VanDerWaalsContact OE1-NE 3.14Å; E791-R795 IonicContact OE1-NH2 2.66Å; E791-R795 PolarHBondContact OE1-NH2 3Å; E791-R795 IonicContact OE2-CZ 2.75Å; E791-R795 IonicContact OE2-NE 3.18Å; E791-R795 IonicContact OE2-NH2 3.7Å; E791-R795 PolarHBondContact OE2-NH2 2.99Å; Q792-R795 CarbonylContact O-C 3.59Å; Q792-R795 WeakPolarHBondContact O-CA 3.37Å; Q792-R795 PolarHBondContact O-N 3.11Å; R795-L798 PolarHBondContact O-N 2.91Å
796	L	42.9	Very low	45.2	Very low	35 Å²	35	100.9 Å²	100.9	18%	0.183	48%	0.478	C	S	.	.	H	α-helix	trans	-70.8	-38.9	176.3	-67.9	162.4	0	0	0	110.7	Q792 V793 L798 R799 L802	Q792-L796 HydrophobicContact CB-CD1 4.26Å; Q792-L796 WeakPolarHBondContact O-CB 3.27Å; Q792-L796 WeakPolarHBondContact O-CD1 3.19Å; Q792-L796 WeakPolarHBondContact O-CG 3.16Å; Q792-L796 PolarHBondContact O-N 2.7Å; V793-L796 PolarHBondContact O-N 2.7Å; L796-L798 PolarHBondContact O-N 3Å; L796-R799 PolarHBondContact O-N 3Å; L796-L802 HydrophobicContact CD1-CD2 4.03Å; L796-L802 HydrophobicContact CD2-CD2 4.18Å; L796-L802 HydrophobicContact CD2-CG 4.18Å
797	Q	44.4	Very low	46.3	Very low	126 Å²	126	101 Å²	101	59%	0.589	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	6.5	173.1	-154.3	-179.2	3.6	0	0	114.2	V793	V793-Q797 WeakPolarHBondContact O-CB 3.38Å; V793-Q797 PolarHBondContact O-N 2.86Å
798	L	40.3	Very low	47.8	Very low	144 Å²	144	93.4 Å²	93.4	75%	0.754	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.4	3.9	-178.3	-77.9	169.4	0	0	0	113.8	R795 L796	R795-L798 PolarHBondContact O-N 2.91Å; L796-L798 PolarHBondContact O-N 3Å
799	R	38.5	Very low	49.7	Very low	206 Å²	206	91.9 Å²	91.9	78%	0.777	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.5	6.7	-165.8	-73.8	-167.6	169.3	-177.1	-3.7	117.9	L796 K801	L796-R799 PolarHBondContact O-N 3Å; R799-K801 PolarHBondContact O-N 2.99Å
800	N	42.3	Very low	51.3	Low	121 Å²	121	92.8 Å²	92.8	65%	0.647	45%	0.45	S	S	*	.	S	Bend	trans	47	22.3	171.3	-64	16.1	0	0	0	117.7	E967	N800-E967 PolarHBondContact ND2-OE1 2.98Å
801	K	41.2	Very low	52.8	Low	170 Å²	170	93.3 Å²	93.3	74%	0.739	45%	0.446	S	S	*	.			trans	-141.1	122.7	165.4	-71.7	-166.9	177.2	-175.2	0	109.3	R799 T803	R799-K801 PolarHBondContact O-N 2.99Å; K801-T803 PolarHBondContact O-N 3.33Å
802	L	45.4	Very low	54.5	Low	59 Å²	59	88.8 Å²	88.8	31%	0.309	43%	0.425	S	S	.	.			trans	-95.8	78.7	-167	-144.1	165.3	0	0	0	111.6	L796 I804 Y843	L796-L802 HydrophobicContact CD1-CD2 4.03Å; L796-L802 HydrophobicContact CD2-CD2 4.18Å; L796-L802 HydrophobicContact CD2-CG 4.18Å; L802-I804 HydrophobicContact CD2-CD1 4.23Å; L802-I804 HydrophobicContact CD2-CG1 3.58Å; L802-I804 PolarHBondContact O-N 3.48Å; L802-I804 VanDerWaalsContact O-N 3.13Å; L802-Y843 HydrophobicContact CB-CD1 4.39Å; L802-Y843 HydrophobicContact CB-CE1 3.68Å; L802-Y843 HydrophobicContact CD1-CD1 3.81Å; L802-Y843 HydrophobicContact CD1-CE1 3.98Å; L802-Y843 HydrophobicContact CD1-CG 4.27Å; L802-Y843 HydrophobicContact CD2-CD1 4.08Å; L802-Y843 HydrophobicContact CD2-CE1 3.85Å; L802-Y843 HydrophobicContact CG-CD1 4.31Å; L802-Y843 HydrophobicContact CG-CE1 4.03Å
803	T	45.2	Very low	56.5	Low	112 Å²	112	86.7 Å²	86.7	69%	0.687	42%	0.416	S	S	*	.			trans	-74.8	96.6	174.4	35.9	0	0	0	0	111.4	K801	K801-T803 PolarHBondContact O-N 3.33Å
804	I	56.9	Low	58.4	Low	35 Å²	35	90.1 Å²	90.1	18%	0.179	43%	0.433	C	S	.	.			trans	-79.8	138.1	170.2	-56.7	162.1	0	0	0	109.2	L802 L808 L809 Y843 L844 C847	L802-I804 HydrophobicContact CD2-CD1 4.23Å; L802-I804 HydrophobicContact CD2-CG1 3.58Å; L802-I804 PolarHBondContact O-N 3.48Å; L802-I804 VanDerWaalsContact O-N 3.13Å; I804-L808 HydrophobicContact CG2-CB 4.14Å; I804-L808 HydrophobicContact CG2-CD2 4.05Å; I804-L808 HydrophobicContact CG2-CG 4.39Å; I804-L809 HydrophobicContact CD1-CD2 4.3Å; I804-L809 HydrophobicContact CG2-CD1 4.37Å; I804-L809 HydrophobicContact CG2-CD2 3.84Å; I804-L809 HydrophobicContact CG2-CG 3.81Å; I804-Y843 HydrophobicContact CD1-CD1 3.79Å; I804-Y843 HydrophobicContact CD1-CE1 3.62Å; I804-Y843 HydrophobicContact CG1-CE1 4.3Å; I804-L844 HydrophobicContact CD1-CD2 3.92Å; I804-L844 HydrophobicContact CG1-CD2 4.38Å; I804-L844 HydrophobicContact CG2-CD2 4.46Å; I804-C847 HydrophobicContact CD1-CB 3.65Å
805	T	60.9	Low	60.3	Low	44 Å²	44	84.3 Å²	84.3	27%	0.27	41%	0.408	S	S	.	.			trans	-70.6	142.1	172.5	55.3	0	0	0	0	111.9	D807 L808 L809	T805-D807 PolarHBondContact O-N 3.39Å; T805-L808 PolarHBondContact O-N 2.82Å; T805-L809 PolarHBondContact O-N 3.36Å
806	E	68.2	Low	62.4	Low	124 Å²	124	82.4 Å²	82.4	58%	0.579	41%	0.412	S	S	*	.	H	α-helix	trans	-60.2	-33.1	176.6	-173.9	161.5	-163.3	0	0	112.2	L808 L809 S810 H851	E806-L808 VanDerWaalsContact C-N 3.29Å; E806-L808 PolarHBondContact O-N 2.9Å; E806-L809 PolarHBondContact O-N 3.15Å; E806-S810 VanDerWaalsContact O-CB 3.26Å; E806-S810 WeakPolarHBondContact O-CB 3.24Å; E806-S810 PolarHBondContact O-N 2.87Å; E806-S810 PolarHBondContact O-OG 3.2Å; E806-H851 WeakPolarHBondContact CG-CE1 3.45Å; E806-H851 IonicContact OE1-CE1 3.61Å; E806-H851 PolarHBondContact OE1-CE1 3.38Å
807	D	68.4	Low	64.4	Low	129 Å²	129	85.3 Å²	85.3	69%	0.69	43%	0.427	S	S	*	.	H	α-helix	trans	-53.3	-43.4	171.4	-59.2	-41.6	0	0	0	112.8	T805 R811	T805-D807 PolarHBondContact O-N 3.39Å; D807-R811 WeakPolarHBondContact O-CB 3.37Å; D807-R811 PolarHBondContact O-N 2.84Å
808	L	73.1	Confident	66.3	Low	23 Å²	23	81 Å²	81	12%	0.12	41%	0.406	C	S	.	.	H	α-helix	trans	-71.9	-40.9	-177.8	-177.2	59.5	0	0	0	110.7	I804 T805 E806 L812 L828 L844	I804-L808 HydrophobicContact CG2-CB 4.14Å; I804-L808 HydrophobicContact CG2-CD2 4.05Å; I804-L808 HydrophobicContact CG2-CG 4.39Å; T805-L808 PolarHBondContact O-N 2.82Å; E806-L808 VanDerWaalsContact C-N 3.29Å; E806-L808 PolarHBondContact O-N 2.9Å; L808-L812 HydrophobicContact CD1-CD1 4.31Å; L808-L812 HydrophobicContact CD1-CG 4.32Å; L808-L812 HydrophobicContact CG-CD1 4.23Å; L808-L812 WeakPolarHBondContact O-CB 3.21Å; L808-L812 VanDerWaalsContact O-CG 3.24Å; L808-L812 WeakPolarHBondContact O-CG 3.31Å; L808-L812 PolarHBondContact O-N 3.48Å; L808-L828 HydrophobicContact CD1-CD2 4.44Å; L808-L828 HydrophobicContact CD2-CD1 4.46Å; L808-L828 HydrophobicContact CD2-CD2 4.02Å; L808-L844 HydrophobicContact CD2-CD2 4.2Å
809	L	79.8	Confident	68.5	Low	20 Å²	20	78.2 Å²	78.2	11%	0.105	40%	0.397	C	S	.	.	H	α-helix	trans	-65.3	-47.3	175.6	-60.8	178	0	0	0	110.8	I804 T805 E806 R811 L812 V813 C847 H851	I804-L809 HydrophobicContact CD1-CD2 4.3Å; I804-L809 HydrophobicContact CG2-CD1 4.37Å; I804-L809 HydrophobicContact CG2-CD2 3.84Å; I804-L809 HydrophobicContact CG2-CG 3.81Å; T805-L809 PolarHBondContact O-N 3.36Å; E806-L809 PolarHBondContact O-N 3.15Å; L809-R811 PolarHBondContact O-N 2.95Å; L809-L812 PolarHBondContact O-N 2.99Å; L809-V813 WeakPolarHBondContact O-CB 3.11Å; L809-V813 WeakPolarHBondContact O-CG2 3.19Å; L809-V813 PolarHBondContact O-N 2.87Å; L809-C847 HydrophobicContact CD1-CB 4.34Å; L809-C847 HydrophobicContact CD2-CB 3.85Å; L809-H851 HydrophobicContact CB-CB 4.04Å; L809-H851 VanDerWaalsContact CB-CD2 3.48Å; L809-H851 WeakPolarHBondContact CB-CD2 3.08Å; L809-H851 HydrophobicContact CD1-CB 4.22Å
810	S	78.3	Confident	70.7	Confident	34 Å²	34	72.7 Å²	72.7	24%	0.238	38%	0.383	C	S	.	.	H	α-helix	trans	-57.8	-46.4	175.4	-68	0	0	0	0	111.9	E806 V813 N814 H851	E806-S810 VanDerWaalsContact O-CB 3.26Å; E806-S810 WeakPolarHBondContact O-CB 3.24Å; E806-S810 PolarHBondContact O-N 2.87Å; E806-S810 PolarHBondContact O-OG 3.2Å; S810-V813 PolarHBondContact O-N 3.48Å; S810-N814 VanDerWaalsContact O-CB 3.25Å; S810-N814 WeakPolarHBondContact O-CB 3.49Å; S810-N814 PolarHBondContact O-N 2.79Å; S810-N814 PolarHBondContact O-ND2 3.43Å; S810-N814 VanDerWaalsContact O-ND2 3.12Å; S810-H851 WeakPolarHBondContact CA-NE2 3.46Å; S810-H851 WeakPolarHBondContact CB-NE2 3.44Å; S810-H851 PolarHBondContact N-NE2 3.41Å; S810-H851 PolarHBondContact OG-NE2 3.21Å
811	R	78.5	Confident	72.9	Confident	98 Å²	98	67.1 Å²	67.1	37%	0.37	35%	0.353	S	S	.	.	H	α-helix	trans	-60.1	-47	176.1	-179	169.2	173.1	139.7	-3.4	112	D807 L809 N814 H815 D824	D807-R811 WeakPolarHBondContact O-CB 3.37Å; D807-R811 PolarHBondContact O-N 2.84Å; L809-R811 PolarHBondContact O-N 2.95Å; R811-N814 PolarHBondContact O-N 3.31Å; R811-H815 PolarHBondContact O-CD2 3.08Å; R811-D824 IonicContact CZ-OD1 2.62Å; R811-D824 IonicContact CZ-OD2 3.78Å; R811-D824 VanDerWaalsContact CZ-OD2 3.27Å; R811-D824 IonicContact NE-OD1 2.89Å; R811-D824 IonicContact NE-OD2 3.26Å; R811-D824 PolarHBondContact NE-OD2 3.05Å; R811-D824 VanDerWaalsContact NH2-CG 3.25Å; R811-D824 IonicContact NH2-OD1 2.64Å; R811-D824 PolarHBondContact NH2-OD1 3.34Å; R811-D824 IonicContact NH2-OD2 3.13Å; R811-D824 PolarHBondContact NH2-OD2 3.38Å
812	L	80.3	Confident	75.2	Confident	5 Å²	5	59.9 Å²	59.9	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-65.6	-38.4	179.2	-71.6	176.7	0	0	0	112.8	L808 L809 H815 F821 I825 L844	L808-L812 HydrophobicContact CD1-CD1 4.31Å; L808-L812 HydrophobicContact CD1-CG 4.32Å; L808-L812 HydrophobicContact CG-CD1 4.23Å; L808-L812 WeakPolarHBondContact O-CB 3.21Å; L808-L812 VanDerWaalsContact O-CG 3.24Å; L808-L812 WeakPolarHBondContact O-CG 3.31Å; L808-L812 PolarHBondContact O-N 3.48Å; L809-L812 PolarHBondContact O-N 2.99Å; L812-H815 PolarHBondContact O-CD2 3.08Å; L812-F821 HydrophobicContact CD2-CD2 4.39Å; L812-F821 HydrophobicContact CD2-CE2 4.46Å; L812-I825 HydrophobicContact CD1-CD1 4.07Å; L812-I825 HydrophobicContact CD2-CD1 3.55Å; L812-I825 HydrophobicContact CD2-CG1 4.08Å; L812-I825 HydrophobicContact CG-CD1 4.49Å; L812-L844 HydrophobicContact CD1-CD2 4.47Å
813	V	81.6	Confident	77.1	Confident	8 Å²	8	59.2 Å²	59.2	5%	0.048	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-37.3	177.3	170.7	0	0	0	0	112.1	L809 S810 H815 I852 I934	L809-V813 WeakPolarHBondContact O-CB 3.11Å; L809-V813 WeakPolarHBondContact O-CG2 3.19Å; L809-V813 PolarHBondContact O-N 2.87Å; S810-V813 PolarHBondContact O-N 3.48Å; V813-H815 PolarHBondContact O-N 3.34Å; V813-I852 HydrophobicContact CB-CG1 4.4Å; V813-I852 HydrophobicContact CG1-CD1 4.21Å; V813-I852 HydrophobicContact CG1-CG1 3.64Å; V813-I852 HydrophobicContact CG2-CD1 4.2Å; V813-I852 HydrophobicContact CG2-CG1 3.79Å; V813-I934 HydrophobicContact CB-CD1 4.26Å; V813-I934 HydrophobicContact CG2-CD1 3.67Å
814	N	82.5	Confident	78.9	Confident	118 Å²	118	55.3 Å²	55.3	63%	0.631	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-4.7	-177.2	-73.1	-23	0	0	0	114.3	S810 R811 T816	S810-N814 VanDerWaalsContact O-CB 3.25Å; S810-N814 WeakPolarHBondContact O-CB 3.49Å; S810-N814 PolarHBondContact O-N 2.79Å; S810-N814 PolarHBondContact O-ND2 3.43Å; S810-N814 VanDerWaalsContact O-ND2 3.12Å; R811-N814 PolarHBondContact O-N 3.31Å; N814-T816 PolarHBondContact O-N 3.13Å
815	H	83	Confident	80.2	Confident	18 Å²	18	53.8 Å²	53.8	8%	0.083	29%	0.292	C	S	.	.			trans	-68.1	104.6	175.3	-67.8	-49.8	0	0	0	112.8	R811 L812 V813 N817 F821 D824 R933 Y937	R811-H815 PolarHBondContact O-CD2 3.08Å; L812-H815 PolarHBondContact O-CD2 3.08Å; V813-H815 PolarHBondContact O-N 3.34Å; H815-N817 VanDerWaalsContact C-N 3.35Å; H815-F821 HydrophobicContact CB-CB 4.04Å; H815-F821 AromaticContact CD2-CD2 3.81Å; H815-D824 IonicContact CE1-OD2 3.29Å; H815-D824 PolarHBondContact CE1-OD2 3.01Å; H815-D824 IonicContact NE2-OD2 3.64Å; H815-D824 PolarHBondContact NE2-OD2 3.26Å; H815-R933 WeakPolarHBondContact O-CD 3.45Å; H815-Y937 HydrophobicContact CB-CE2 4.3Å
816	T	79.4	Confident	81.4	Confident	101 Å²	101	52.6 Å²	52.6	62%	0.62	28%	0.283	S	S	*	.			trans	-80.7	-15	167.4	54.6	0	0	0	0	113.5	N814 Y937	N814-T816 PolarHBondContact O-N 3.13Å; T816-Y937 VanDerWaalsContact C-OH 3.26Å; T816-Y937 PolarHBondContact O-OH 3.35Å
817	N	84.4	Confident	82	Confident	96 Å²	96	52.5 Å²	52.5	51%	0.513	29%	0.287	S	S	.	.	S	Bend	trans	-125.5	119	-174.3	-81.5	-48.4	0	0	0	111.7	H815 P819 N820 F821 Y937	H815-N817 VanDerWaalsContact C-N 3.35Å; N817-P819 VanDerWaalsContact C-CD 3.46Å; N817-N820 PolarHBondContact O-N 2.83Å; N817-N820 VanDerWaalsContact O-N 3.12Å; N817-F821 PolarHBondContact O-N 2.8Å; N817-Y937 PolarHBondContact N-OH 3.1Å
818	Y	84.8	Confident	82.4	Confident	35 Å²	35	48 Å²	48	14%	0.137	26%	0.262	C	S	.	.	H	α-helix	trans	-55	-37.7	-178.9	172.8	-97.7	0	0	0	115.2	N820 F821 E822 Y937 T940	Y818-N820 PolarHBondContact O-N 3.38Å; Y818-F821 HydrophobicContact CD2-CD1 4.49Å; Y818-F821 HydrophobicContact CE2-CD1 4.39Å; Y818-F821 PolarHBondContact O-N 3.08Å; Y818-E822 HydrophobicContact CE1-CB 4.14Å; Y818-E822 WeakPolarHBondContact CE1-OE2 3.48Å; Y818-E822 WeakPolarHBondContact O-CB 3.41Å; Y818-E822 PolarHBondContact O-N 3.46Å; Y818-E822 PolarHBondContact OH-OE2 3.25Å; Y818-Y937 AromaticContact CD2-CD1 3.95Å; Y818-Y937 HydrophobicContact CD2-CD1 3.95Å; Y818-Y937 HydrophobicContact CD2-CD2 4.33Å; Y818-Y937 HydrophobicContact CD2-CE1 4.45Å; Y818-Y937 AromaticContact CD2-CG 3.87Å; Y818-Y937 HydrophobicContact CD2-CG 3.87Å; Y818-Y937 HydrophobicContact CG-CD1 4.5Å; Y818-Y937 PolarHBondContact N-OH 2.81Å; Y818-Y937 VanDerWaalsContact N-OH 3.13Å; Y818-T940 HydrophobicContact CD2-CG2 4.29Å; Y818-T940 HydrophobicContact CE1-CG2 3.93Å; Y818-T940 HydrophobicContact CE2-CG2 3.67Å
819	P	85.6	Confident	82.8	Confident	86 Å²	86	47.3 Å²	47.3	56%	0.558	26%	0.259	S	S	*	.	H	α-helix	trans	-60.4	-30.2	177.3	-26.5	36.6	0	0	0	114.5	N817 A823	N817-P819 VanDerWaalsContact C-CD 3.46Å; P819-A823 PolarHBondContact O-N 2.96Å
820	N	85.5	Confident	82.7	Confident	91 Å²	91	47.3 Å²	47.3	49%	0.487	26%	0.264	S	S	.	.	H	α-helix	trans	-76.7	-43.2	180	-60.9	26.3	0	0	0	110.1	N817 Y818 E822 A823 D824	N817-N820 PolarHBondContact O-N 2.83Å; N817-N820 VanDerWaalsContact O-N 3.12Å; Y818-N820 PolarHBondContact O-N 3.38Å; N820-E822 VanDerWaalsContact C-N 3.3Å; N820-E822 PolarHBondContact O-N 3.13Å; N820-A823 PolarHBondContact O-N 2.91Å; N820-D824 PolarHBondContact O-N 2.96Å
821	F	87.9	Confident	82.9	Confident	4 Å²	4	54 Å²	54	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-58.7	-41.3	169.1	177.8	-80.9	0	0	0	111.6	L812 H815 N817 Y818 A823 I825 Y937 F941	L812-F821 HydrophobicContact CD2-CD2 4.39Å; L812-F821 HydrophobicContact CD2-CE2 4.46Å; H815-F821 HydrophobicContact CB-CB 4.04Å; H815-F821 AromaticContact CD2-CD2 3.81Å; N817-F821 PolarHBondContact O-N 2.8Å; Y818-F821 HydrophobicContact CD2-CD1 4.49Å; Y818-F821 HydrophobicContact CE2-CD1 4.39Å; Y818-F821 PolarHBondContact O-N 3.08Å; F821-A823 VanDerWaalsContact C-N 3.34Å; F821-A823 PolarHBondContact O-N 2.95Å; F821-I825 HydrophobicContact CD1-CG1 4.06Å; F821-I825 HydrophobicContact CD2-CG1 4.46Å; F821-I825 HydrophobicContact CE1-CG1 3.78Å; F821-I825 HydrophobicContact CE2-CD1 4.49Å; F821-I825 HydrophobicContact CE2-CG1 4.2Å; F821-I825 HydrophobicContact CG-CG1 4.38Å; F821-I825 HydrophobicContact CZ-CD1 4.3Å; F821-I825 HydrophobicContact CZ-CG1 3.85Å; F821-I825 WeakPolarHBondContact O-CB 3.4Å; F821-I825 VanDerWaalsContact O-CG1 3.29Å; F821-I825 WeakPolarHBondContact O-CG1 3.32Å; F821-I825 PolarHBondContact O-N 2.98Å; F821-Y937 HydrophobicContact CB-CD2 3.71Å; F821-Y937 HydrophobicContact CB-CE2 4.21Å; F821-Y937 HydrophobicContact CD1-CD2 4.23Å; F821-Y937 HydrophobicContact CD1-CG 4.44Å; F821-Y937 AromaticContact CD2-CD2 3.88Å; F821-Y937 HydrophobicContact CD2-CD2 3.88Å; F821-Y937 AromaticContact CG-CD2 3.69Å; F821-Y937 HydrophobicContact CG-CD2 3.69Å; F821-Y937 HydrophobicContact CG-CG 4.32Å; F821-F941 HydrophobicContact CE1-CB 4.2Å
822	E	89	Confident	82.9	Confident	18 Å²	18	56.3 Å²	56.3	8%	0.084	30%	0.299	C	S	.	.	H	α-helix	trans	-62.8	-40.8	176	-175	177.6	158	0	0	111.5	Y818 N820 L826 F941 R944 W945	Y818-E822 HydrophobicContact CE1-CB 4.14Å; Y818-E822 WeakPolarHBondContact CE1-OE2 3.48Å; Y818-E822 WeakPolarHBondContact O-CB 3.41Å; Y818-E822 PolarHBondContact O-N 3.46Å; Y818-E822 PolarHBondContact OH-OE2 3.25Å; N820-E822 VanDerWaalsContact C-N 3.3Å; N820-E822 PolarHBondContact O-N 3.13Å; E822-L826 HydrophobicContact CG-CD1 4.21Å; E822-L826 HydrophobicContact CG-CG 4.39Å; E822-L826 WeakPolarHBondContact O-CB 3.48Å; E822-L826 WeakPolarHBondContact O-CG 3.35Å; E822-L826 PolarHBondContact O-N 3.3Å; E822-F941 HydrophobicContact CG-CD2 4.31Å; E822-R944 IonicContact OE1-CZ 2.67Å; E822-R944 IonicContact OE1-NE 3.25Å; E822-R944 PolarHBondContact OE1-NE 2.96Å; E822-R944 IonicContact OE1-NH2 3.43Å; E822-R944 PolarHBondContact OE1-NH2 3.14Å; E822-R944 IonicContact OE2-CZ 3.29Å; E822-R944 IonicContact OE2-NE 2.75Å; E822-R944 PolarHBondContact OE2-NE 2.83Å; E822-R944 IonicContact OE2-NH2 2.69Å; E822-R944 PolarHBondContact OE2-NH2 2.77Å; E822-W945 VanDerWaalsContact OE1-CZ2 3.31Å; E822-W945 WeakPolarHBondContact OE1-CZ2 3.38Å; E822-W945 PolarHBondContact OE1-NE1 3.29Å
823	A	85.2	Confident	83	Confident	44 Å²	44	57.1 Å²	57.1	36%	0.364	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-52.7	176.1	0	0	0	0	0	111.9	P819 N820 F821 I825 L826 D827	P819-A823 PolarHBondContact O-N 2.96Å; N820-A823 PolarHBondContact O-N 2.91Å; F821-A823 VanDerWaalsContact C-N 3.34Å; F821-A823 PolarHBondContact O-N 2.95Å; A823-I825 PolarHBondContact O-N 2.76Å; A823-L826 CarbonylContact O-C 3.57Å; A823-L826 WeakPolarHBondContact O-CA 3.31Å; A823-L826 WeakPolarHBondContact O-CB 3.45Å; A823-L826 PolarHBondContact O-N 2.82Å; A823-L826 VanDerWaalsContact O-N 3.09Å; A823-D827 PolarHBondContact O-N 3.15Å
824	D	83.4	Confident	82.7	Confident	31 Å²	31	59.8 Å²	59.8	17%	0.166	32%	0.318	C	S	.	.	H	α-helix	trans	-65	-40.1	-175.4	-74.4	-7.9	0	0	0	112.5	R811 H815 N820 D827 L828	R811-D824 IonicContact CZ-OD1 2.62Å; R811-D824 IonicContact CZ-OD2 3.78Å; R811-D824 VanDerWaalsContact CZ-OD2 3.27Å; R811-D824 IonicContact NE-OD1 2.89Å; R811-D824 IonicContact NE-OD2 3.26Å; R811-D824 PolarHBondContact NE-OD2 3.05Å; R811-D824 VanDerWaalsContact NH2-CG 3.25Å; R811-D824 IonicContact NH2-OD1 2.64Å; R811-D824 PolarHBondContact NH2-OD1 3.34Å; R811-D824 IonicContact NH2-OD2 3.13Å; R811-D824 PolarHBondContact NH2-OD2 3.38Å; H815-D824 IonicContact CE1-OD2 3.29Å; H815-D824 PolarHBondContact CE1-OD2 3.01Å; H815-D824 IonicContact NE2-OD2 3.64Å; H815-D824 PolarHBondContact NE2-OD2 3.26Å; N820-D824 PolarHBondContact O-N 2.96Å; D824-D827 PolarHBondContact O-N 3.25Å; D824-L828 VanDerWaalsContact O-CB 3.27Å; D824-L828 WeakPolarHBondContact O-CB 3.19Å; D824-L828 PolarHBondContact O-N 3.24Å
825	I	84.8	Confident	82.3	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-70.8	-32.5	173.7	-59.5	-69.7	0	0	0	111.4	L812 F821 A823 L829 L841 F941	L812-I825 HydrophobicContact CD1-CD1 4.07Å; L812-I825 HydrophobicContact CD2-CD1 3.55Å; L812-I825 HydrophobicContact CD2-CG1 4.08Å; L812-I825 HydrophobicContact CG-CD1 4.49Å; F821-I825 HydrophobicContact CD1-CG1 4.06Å; F821-I825 HydrophobicContact CD2-CG1 4.46Å; F821-I825 HydrophobicContact CE1-CG1 3.78Å; F821-I825 HydrophobicContact CE2-CD1 4.49Å; F821-I825 HydrophobicContact CE2-CG1 4.2Å; F821-I825 HydrophobicContact CG-CG1 4.38Å; F821-I825 HydrophobicContact CZ-CD1 4.3Å; F821-I825 HydrophobicContact CZ-CG1 3.85Å; F821-I825 WeakPolarHBondContact O-CB 3.4Å; F821-I825 VanDerWaalsContact O-CG1 3.29Å; F821-I825 WeakPolarHBondContact O-CG1 3.32Å; F821-I825 PolarHBondContact O-N 2.98Å; A823-I825 PolarHBondContact O-N 2.76Å; I825-L829 HydrophobicContact CG2-CD1 3.72Å; I825-L829 HydrophobicContact CG2-CG 4.18Å; I825-L829 WeakPolarHBondContact O-CB 3.43Å; I825-L829 PolarHBondContact O-N 2.93Å; I825-L841 HydrophobicContact CG2-CD1 3.88Å; I825-F941 HydrophobicContact CB-CD2 4.05Å; I825-F941 HydrophobicContact CB-CE2 3.76Å; I825-F941 HydrophobicContact CB-CZ 4.2Å; I825-F941 HydrophobicContact CG2-CD1 4.06Å; I825-F941 HydrophobicContact CG2-CD2 3.87Å; I825-F941 HydrophobicContact CG2-CE1 3.71Å; I825-F941 HydrophobicContact CG2-CE2 3.48Å; I825-F941 VanDerWaalsContact CG2-CE2 3.48Å; I825-F941 HydrophobicContact CG2-CG 4.15Å; I825-F941 HydrophobicContact CG2-CZ 3.42Å; I825-F941 VanDerWaalsContact CG2-CZ 3.42Å
826	L	85.9	Confident	81.6	Confident	18 Å²	18	57.1 Å²	57.1	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-34.8	173	-85	-175.4	0	0	0	113	E822 A823 G830 R831 F941 W945	E822-L826 HydrophobicContact CG-CD1 4.21Å; E822-L826 HydrophobicContact CG-CG 4.39Å; E822-L826 WeakPolarHBondContact O-CB 3.48Å; E822-L826 WeakPolarHBondContact O-CG 3.35Å; E822-L826 PolarHBondContact O-N 3.3Å; A823-L826 CarbonylContact O-C 3.57Å; A823-L826 WeakPolarHBondContact O-CA 3.31Å; A823-L826 WeakPolarHBondContact O-CB 3.45Å; A823-L826 PolarHBondContact O-N 2.82Å; A823-L826 VanDerWaalsContact O-N 3.09Å; L826-G830 WeakPolarHBondContact O-CA 3.16Å; L826-G830 PolarHBondContact O-N 3.22Å; L826-R831 HydrophobicContact CD1-CG 4.42Å; L826-R831 HydrophobicContact CD2-CB 4.41Å; L826-R831 HydrophobicContact CD2-CG 3.57Å; L826-F941 HydrophobicContact CD2-CE2 3.89Å; L826-F941 HydrophobicContact CD2-CZ 3.94Å; L826-F941 HydrophobicContact CG-CE2 3.88Å; L826-F941 HydrophobicContact CG-CZ 4.41Å; L826-W945 HydrophobicContact CD1-CH2 4.23Å; L826-W945 HydrophobicContact CD1-CZ2 3.62Å; L826-W945 HydrophobicContact CD2-CD2 3.91Å; L826-W945 HydrophobicContact CD2-CE3 4.34Å; L826-W945 HydrophobicContact CD2-CG 4.24Å; L826-W945 HydrophobicContact CD2-CZ2 4.21Å; L826-W945 HydrophobicContact CG-CZ2 4.42Å
827	D	80.8	Confident	81.5	Confident	122 Å²	122	56.2 Å²	56.2	65%	0.652	29%	0.286	S	S	*	.	H	α-helix	trans	-79.7	-32.2	178.1	-76.9	-23.2	0	0	0	111.9	A823 D824	A823-D827 PolarHBondContact O-N 3.15Å; D824-D827 PolarHBondContact O-N 3.25Å
828	L	77.6	Confident	81.2	Confident	34 Å²	34	52.3 Å²	52.3	18%	0.178	27%	0.265	C	S	.	.	H	α-helix	trans	-73	-50.3	175.2	-178.1	63.2	0	0	0	113.1	C789 L808 D824 L844	C789-L828 HydrophobicContact CB-CD1 3.87Å; L808-L828 HydrophobicContact CD1-CD2 4.44Å; L808-L828 HydrophobicContact CD2-CD1 4.46Å; L808-L828 HydrophobicContact CD2-CD2 4.02Å; D824-L828 VanDerWaalsContact O-CB 3.27Å; D824-L828 WeakPolarHBondContact O-CB 3.19Å; D824-L828 PolarHBondContact O-N 3.24Å; L828-L844 HydrophobicContact CD2-CD1 3.56Å; L828-L844 HydrophobicContact CD2-CD2 4.37Å
829	L	79.9	Confident	80.4	Confident	9 Å²	9	52.3 Å²	52.3	5%	0.047	27%	0.273	C	S	.	.	H	α-helix	trans	-98.9	-21.3	-174.7	-57.7	-178.4	0	0	0	113.5	I825 R837 I840 L841 L844 Y946	I825-L829 HydrophobicContact CG2-CD1 3.72Å; I825-L829 HydrophobicContact CG2-CG 4.18Å; I825-L829 WeakPolarHBondContact O-CB 3.43Å; I825-L829 PolarHBondContact O-N 2.93Å; L829-R837 VanDerWaalsContact O-CD 3.23Å; L829-R837 WeakPolarHBondContact O-CD 3.39Å; L829-R837 PolarHBondContact O-NE 3.36Å; L829-R837 PolarHBondContact O-NH1 3.08Å; L829-I840 HydrophobicContact CD2-CB 4.11Å; L829-I840 HydrophobicContact CD2-CG2 3.64Å; L829-L841 HydrophobicContact CD1-CB 3.73Å; L829-L841 HydrophobicContact CD1-CD1 4Å; L829-L841 HydrophobicContact CD1-CG 4.36Å; L829-L844 HydrophobicContact CD2-CD1 4.35Å; L829-Y946 WeakPolarHBondContact CB-OH 3.49Å; L829-Y946 HydrophobicContact CD1-CE2 4.5Å
830	G	79	Confident	79.7	Confident	20 Å²	20	49.5 Å²	49.5	21%	0.206	25%	0.252	C	S	.	.			trans	76.6	156.7	-173.8	0	0	0	0	0	114.2	L826 Q832 Y946	L826-G830 WeakPolarHBondContact O-CA 3.16Å; L826-G830 PolarHBondContact O-N 3.22Å; G830-Q832 VanDerWaalsContact C-N 3.25Å; G830-Q832 PolarHBondContact O-N 3.36Å; G830-Y946 PolarHBondContact O-OH 2.87Å
831	R	81.2	Confident	79.5	Confident	174 Å²	174	45.4 Å²	45.4	66%	0.657	23%	0.231	S	C	*	.	S	Bend	trans	-67.8	-16.5	-179.9	-68.3	176.2	-173.7	168.3	5.6	114.9	L826 P833 W945	L826-R831 HydrophobicContact CD1-CG 4.42Å; L826-R831 HydrophobicContact CD2-CB 4.41Å; L826-R831 HydrophobicContact CD2-CG 3.57Å; R831-P833 WeakPolarHBondContact O-CD 3.45Å; R831-W945 HydrophobicContact CB-CE3 4.48Å; R831-W945 HydrophobicContact CB-CZ3 4.32Å; R831-W945 HydrophobicContact CG-CE3 4.35Å; R831-W945 HydrophobicContact CG-CH2 4.31Å; R831-W945 HydrophobicContact CG-CZ3 3.94Å
832	Q	80.1	Confident	79	Confident	148 Å²	148	52.7 Å²	52.7	69%	0.692	26%	0.259	S	S	*	.	S	Bend	trans	-88.4	115.9	-179	-63.8	-68	11.2	0	0	110.6	G830 R837	G830-Q832 VanDerWaalsContact C-N 3.25Å; G830-Q832 PolarHBondContact O-N 3.36Å; Q832-R837 VanDerWaalsContact O-CD 3.26Å; Q832-R837 WeakPolarHBondContact O-CD 3.33Å; Q832-R837 PolarHBondContact O-NH1 3.46Å
833	P	81.5	Confident	78.2	Confident	21 Å²	21	55.9 Å²	55.9	14%	0.136	27%	0.271	C	S	.	.			trans	-68.4	141.4	173.1	24.6	-31.7	0	0	0	112.5	R831 Y946 W949	R831-P833 WeakPolarHBondContact O-CD 3.45Å; P833-Y946 HydrophobicContact CB-CD1 3.53Å; P833-Y946 HydrophobicContact CB-CE1 4.05Å; P833-Y946 HydrophobicContact CB-CG 3.98Å; P833-Y946 HydrophobicContact CG-CD1 4.22Å; P833-W949 HydrophobicContact CB-CB 4.01Å; P833-W949 HydrophobicContact CB-CD2 3.73Å; P833-W949 HydrophobicContact CB-CE3 3.93Å; P833-W949 HydrophobicContact CB-CG 3.81Å; P833-W949 HydrophobicContact CG-CB 3.43Å; P833-W949 VanDerWaalsContact CG-CB 3.43Å; P833-W949 HydrophobicContact CG-CD2 3.79Å; P833-W949 HydrophobicContact CG-CE3 4.46Å; P833-W949 HydrophobicContact CG-CG 3.32Å
834	N	75.5	Confident	77.9	Confident	65 Å²	65	54.1 Å²	54.1	35%	0.348	26%	0.256	S	S	.	.			trans	-148.7	168.1	155.6	69	3.7	0	0	0	108.1	H836 R837 I838	N834-H836 PolarHBondContact O-N 3.3Å; N834-R837 PolarHBondContact O-N 2.62Å; N834-R837 VanDerWaalsContact OD1-CB 3.27Å; N834-R837 WeakPolarHBondContact OD1-CB 3.31Å; N834-R837 VanDerWaalsContact OD1-CD 3.23Å; N834-R837 WeakPolarHBondContact OD1-CD 3.47Å; N834-R837 WeakPolarHBondContact OD1-CG 3.4Å; N834-R837 PolarHBondContact OD1-N 2.66Å; N834-I838 WeakPolarHBondContact O-CG1 3.4Å; N834-I838 PolarHBondContact O-N 2.81Å; N834-I838 VanDerWaalsContact O-N 3.16Å
835	W	73.9	Confident	77.8	Confident	22 Å²	22	53.8 Å²	53.8	8%	0.083	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-42.9	-177.9	-66.9	133.3	0	0	0	113.1	R837 I838 A839 W949 V950 G955 W956 S958 V959 E962	W835-R837 VanDerWaalsContact C-N 3.29Å; W835-R837 PolarHBondContact O-N 3.05Å; W835-I838 HydrophobicContact CD2-CD1 4.5Å; W835-I838 HydrophobicContact CE3-CB 4.35Å; W835-I838 HydrophobicContact CE3-CD1 3.52Å; W835-I838 HydrophobicContact CE3-CG2 4.44Å; W835-I838 HydrophobicContact CZ3-CD1 3.71Å; W835-I838 CarbonylContact O-C 3.35Å; W835-I838 WeakPolarHBondContact O-CA 3.39Å; W835-I838 WeakPolarHBondContact O-CB 3.45Å; W835-I838 PolarHBondContact O-N 3.11Å; W835-A839 PolarHBondContact O-N 2.83Å; W835-W949 AromaticContact CD2-CH2 3.9Å; W835-W949 HydrophobicContact CD2-CH2 3.9Å; W835-W949 AromaticContact CD2-CZ3 3.75Å; W835-W949 HydrophobicContact CD2-CZ3 3.75Å; W835-W949 AromaticContact CE2-CH2 3.81Å; W835-W949 AromaticContact CE2-CZ3 3.75Å; W835-W949 HydrophobicContact CE3-CH2 4.45Å; W835-W949 AromaticContact CE3-CZ3 3.87Å; W835-W949 HydrophobicContact CE3-CZ3 3.87Å; W835-W949 HydrophobicContact CG-CH2 4.13Å; W835-W949 HydrophobicContact CG-CZ3 4.43Å; W835-W949 AromaticContact CH2-CZ3 3.99Å; W835-W949 HydrophobicContact CH2-CZ3 3.99Å; W835-W949 HydrophobicContact CZ2-CH2 4.26Å; W835-W949 AromaticContact CZ2-CZ3 3.85Å; W835-W949 HydrophobicContact CZ2-CZ3 3.85Å; W835-W949 AromaticContact CZ3-CZ3 3.99Å; W835-W949 HydrophobicContact CZ3-CZ3 3.99Å; W835-W949 AromaticContact NE1-CH2 3.99Å; W835-V950 HydrophobicContact CH2-CB 4.24Å; W835-V950 HydrophobicContact CH2-CG1 3.99Å; W835-V950 HydrophobicContact CH2-CG2 3.78Å; W835-V950 HydrophobicContact CZ3-CG1 4.4Å; W835-V950 HydrophobicContact CZ3-CG2 3.63Å; W835-G955 WeakPolarHBondContact CH2-O 3.24Å; W835-W956 HydrophobicContact CZ3-CE3 4.28Å; W835-W956 HydrophobicContact CZ3-CZ3 4.25Å; W835-S958 VanDerWaalsContact CE2-O 3.28Å; W835-S958 WeakPolarHBondContact CZ2-O 3.2Å; W835-S958 PolarHBondContact NE1-O 3.34Å; W835-V959 HydrophobicContact CD2-CG2 3.95Å; W835-V959 HydrophobicContact CE3-CG2 3.61Å; W835-V959 HydrophobicContact CH2-CG2 3.54Å; W835-V959 HydrophobicContact CZ2-CG2 3.89Å; W835-V959 HydrophobicContact CZ3-CG2 3.39Å; W835-E962 PolarHBondContact NE1-OE2 2.96Å
836	H	68.9	Low	77.4	Confident	58 Å²	58	56.9 Å²	56.9	27%	0.269	27%	0.266	S	S	.	.	H	α-helix	trans	-53.8	-41.2	176.2	-171.4	66.4	0	0	0	113	N834 A839 I840 L968	N834-H836 PolarHBondContact O-N 3.3Å; H836-A839 PolarHBondContact O-N 2.77Å; H836-I840 WeakPolarHBondContact O-CB 3.19Å; H836-I840 WeakPolarHBondContact O-CG1 3.24Å; H836-I840 PolarHBondContact O-N 3.29Å; H836-L968 HydrophobicContact CB-CD1 4.07Å
837	R	76.3	Confident	76.9	Confident	82 Å²	82	57 Å²	57	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-72.4	-29.3	175.1	-71.3	161	-176.1	-147	-7.4	113.4	L829 Q832 N834 W835 L841 Y946	L829-R837 VanDerWaalsContact O-CD 3.23Å; L829-R837 WeakPolarHBondContact O-CD 3.39Å; L829-R837 PolarHBondContact O-NE 3.36Å; L829-R837 PolarHBondContact O-NH1 3.08Å; Q832-R837 VanDerWaalsContact O-CD 3.26Å; Q832-R837 WeakPolarHBondContact O-CD 3.33Å; Q832-R837 PolarHBondContact O-NH1 3.46Å; N834-R837 PolarHBondContact O-N 2.62Å; N834-R837 VanDerWaalsContact OD1-CB 3.27Å; N834-R837 WeakPolarHBondContact OD1-CB 3.31Å; N834-R837 VanDerWaalsContact OD1-CD 3.23Å; N834-R837 WeakPolarHBondContact OD1-CD 3.47Å; N834-R837 WeakPolarHBondContact OD1-CG 3.4Å; N834-R837 PolarHBondContact OD1-N 2.66Å; W835-R837 VanDerWaalsContact C-N 3.29Å; W835-R837 PolarHBondContact O-N 3.05Å; R837-L841 VanDerWaalsContact O-CB 3.27Å; R837-L841 WeakPolarHBondContact O-CB 3.46Å; R837-L841 PolarHBondContact O-N 3.05Å; R837-Y946 HydrophobicContact CB-CE2 4.49Å
838	I	78.1	Confident	76.9	Confident	13 Å²	13	51.4 Å²	51.4	7%	0.067	24%	0.238	C	C	.	.	H	α-helix	trans	-71.9	-40.7	173.8	-67	161.8	0	0	0	110	N834 W835 L841 Y842 F942 Y946 W949 V950 W956	N834-I838 WeakPolarHBondContact O-CG1 3.4Å; N834-I838 PolarHBondContact O-N 2.81Å; N834-I838 VanDerWaalsContact O-N 3.16Å; W835-I838 HydrophobicContact CD2-CD1 4.5Å; W835-I838 HydrophobicContact CE3-CB 4.35Å; W835-I838 HydrophobicContact CE3-CD1 3.52Å; W835-I838 HydrophobicContact CE3-CG2 4.44Å; W835-I838 HydrophobicContact CZ3-CD1 3.71Å; W835-I838 CarbonylContact O-C 3.35Å; W835-I838 WeakPolarHBondContact O-CA 3.39Å; W835-I838 WeakPolarHBondContact O-CB 3.45Å; W835-I838 PolarHBondContact O-N 3.11Å; I838-L841 WeakPolarHBondContact O-CB 3.44Å; I838-L841 PolarHBondContact O-N 3.27Å; I838-Y842 PolarHBondContact O-N 3.09Å; I838-F942 HydrophobicContact CD1-CE2 4.38Å; I838-F942 HydrophobicContact CG1-CE2 4.34Å; I838-F942 HydrophobicContact CG2-CD2 4.48Å; I838-F942 HydrophobicContact CG2-CE2 4.04Å; I838-Y946 HydrophobicContact CD1-CD2 4.5Å; I838-Y946 HydrophobicContact CG1-CD2 3.64Å; I838-Y946 HydrophobicContact CG1-CE2 4.25Å; I838-Y946 HydrophobicContact CG1-CG 4.26Å; I838-W949 HydrophobicContact CD1-CE3 4.07Å; I838-W949 HydrophobicContact CD1-CZ3 3.77Å; I838-V950 HydrophobicContact CD1-CG2 3.71Å; I838-W956 HydrophobicContact CG2-CH2 3.92Å; I838-W956 HydrophobicContact CG2-CZ3 3.83Å
839	A	69	Low	77	Confident	36 Å²	36	51 Å²	51	30%	0.298	24%	0.237	S	C	.	.	H	α-helix	trans	-63.7	-46.8	172.3	0	0	0	0	0	111.6	W835 H836 L841 Y842 Y843 L968	W835-A839 PolarHBondContact O-N 2.83Å; H836-A839 PolarHBondContact O-N 2.77Å; A839-L841 VanDerWaalsContact C-N 3.33Å; A839-L841 PolarHBondContact O-N 3.12Å; A839-Y842 WeakPolarHBondContact O-CB 3.48Å; A839-Y842 PolarHBondContact O-N 3.44Å; A839-Y843 WeakPolarHBondContact O-CB 3.44Å; A839-Y843 PolarHBondContact O-N 2.87Å; A839-L968 HydrophobicContact CB-CD2 3.55Å
840	I	71.3	Confident	76.8	Confident	26 Å²	26	55.9 Å²	55.9	13%	0.133	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-40.6	173.8	-65.4	162.7	0	0	0	110.9	L829 H836 Y842 Y843 L844	L829-I840 HydrophobicContact CD2-CB 4.11Å; L829-I840 HydrophobicContact CD2-CG2 3.64Å; H836-I840 WeakPolarHBondContact O-CB 3.19Å; H836-I840 WeakPolarHBondContact O-CG1 3.24Å; H836-I840 PolarHBondContact O-N 3.29Å; I840-Y842 VanDerWaalsContact C-N 3.33Å; I840-Y842 PolarHBondContact O-N 3.04Å; I840-Y843 PolarHBondContact O-N 2.9Å; I840-L844 HydrophobicContact CG2-CD1 3.71Å; I840-L844 HydrophobicContact CG2-CG 3.99Å; I840-L844 VanDerWaalsContact O-CB 3.27Å; I840-L844 WeakPolarHBondContact O-CB 3.43Å; I840-L844 WeakPolarHBondContact O-CG 3.45Å; I840-L844 PolarHBondContact O-N 3.41Å
841	L	81.1	Confident	76.9	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-60.7	-41.3	175.4	179.8	62.8	0	0	0	112.2	I825 L829 R837 I838 A839 T845 T938 F941 F942 Y946	I825-L841 HydrophobicContact CG2-CD1 3.88Å; L829-L841 HydrophobicContact CD1-CB 3.73Å; L829-L841 HydrophobicContact CD1-CD1 4Å; L829-L841 HydrophobicContact CD1-CG 4.36Å; R837-L841 VanDerWaalsContact O-CB 3.27Å; R837-L841 WeakPolarHBondContact O-CB 3.46Å; R837-L841 PolarHBondContact O-N 3.05Å; I838-L841 WeakPolarHBondContact O-CB 3.44Å; I838-L841 PolarHBondContact O-N 3.27Å; A839-L841 VanDerWaalsContact C-N 3.33Å; A839-L841 PolarHBondContact O-N 3.12Å; L841-T845 WeakPolarHBondContact O-CB 3.26Å; L841-T845 PolarHBondContact O-N 2.96Å; L841-T845 VanDerWaalsContact O-N 3.16Å; L841-T845 PolarHBondContact O-OG1 3.5Å; L841-T938 HydrophobicContact CD1-CG2 4.16Å; L841-T938 HydrophobicContact CD2-CG2 4.33Å; L841-T938 HydrophobicContact CG-CG2 3.99Å; L841-F941 HydrophobicContact CD1-CD1 4.34Å; L841-F941 HydrophobicContact CD2-CD1 3.75Å; L841-F941 HydrophobicContact CD2-CE1 4.16Å; L841-F942 HydrophobicContact CD2-CB 4.25Å; L841-Y946 HydrophobicContact CD2-CD2 4.19Å; L841-Y946 HydrophobicContact CD2-CE2 4.2Å
842	Y	77	Confident	77	Confident	157 Å²	157	47.5 Å²	47.5	62%	0.616	22%	0.218	S	C	*	.	H	α-helix	trans	-66.1	-46.8	174.7	177.1	-105.5	0	0	0	111.5	I838 A839 I840 T845 R846	I838-Y842 PolarHBondContact O-N 3.09Å; A839-Y842 WeakPolarHBondContact O-CB 3.48Å; A839-Y842 PolarHBondContact O-N 3.44Å; I840-Y842 VanDerWaalsContact C-N 3.33Å; I840-Y842 PolarHBondContact O-N 3.04Å; Y842-T845 CarbonylContact O-C 3.54Å; Y842-T845 WeakPolarHBondContact O-CA 3.3Å; Y842-T845 WeakPolarHBondContact O-CB 3.25Å; Y842-T845 PolarHBondContact O-N 3.43Å; Y842-T845 VanDerWaalsContact O-N 3.08Å; Y842-R846 PolarHBondContact O-N 3.15Å
843	Y	72.8	Confident	77	Confident	85 Å²	85	40.7 Å²	40.7	33%	0.333	19%	0.186	S	C	.	.	H	α-helix	trans	-63.4	-46.8	179.1	-171.3	-89.4	0	0	0	112.5	L802 I804 A839 I840 T845 R846 C847	L802-Y843 HydrophobicContact CB-CD1 4.39Å; L802-Y843 HydrophobicContact CB-CE1 3.68Å; L802-Y843 HydrophobicContact CD1-CD1 3.81Å; L802-Y843 HydrophobicContact CD1-CE1 3.98Å; L802-Y843 HydrophobicContact CD1-CG 4.27Å; L802-Y843 HydrophobicContact CD2-CD1 4.08Å; L802-Y843 HydrophobicContact CD2-CE1 3.85Å; L802-Y843 HydrophobicContact CG-CD1 4.31Å; L802-Y843 HydrophobicContact CG-CE1 4.03Å; I804-Y843 HydrophobicContact CD1-CD1 3.79Å; I804-Y843 HydrophobicContact CD1-CE1 3.62Å; I804-Y843 HydrophobicContact CG1-CE1 4.3Å; A839-Y843 WeakPolarHBondContact O-CB 3.44Å; A839-Y843 PolarHBondContact O-N 2.87Å; I840-Y843 PolarHBondContact O-N 2.9Å; Y843-T845 PolarHBondContact O-N 3.06Å; Y843-R846 WeakPolarHBondContact O-CB 3.2Å; Y843-R846 PolarHBondContact O-N 3.05Å; Y843-R846 VanDerWaalsContact O-N 3.11Å; Y843-C847 WeakPolarHBondContact CE1-SG 3.37Å; Y843-C847 PolarHBondContact O-N 3.18Å; Y843-C847 PolarHBondContact O-SG 3.36Å
844	L	78.5	Confident	76.8	Confident	8 Å²	8	43.1 Å²	43.1	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-55	-36.8	171	-74.9	167.7	0	0	0	111.5	I804 L808 L812 L828 L829 I840 S848	I804-L844 HydrophobicContact CD1-CD2 3.92Å; I804-L844 HydrophobicContact CG1-CD2 4.38Å; I804-L844 HydrophobicContact CG2-CD2 4.46Å; L808-L844 HydrophobicContact CD2-CD2 4.2Å; L812-L844 HydrophobicContact CD1-CD2 4.47Å; L828-L844 HydrophobicContact CD2-CD1 3.56Å; L828-L844 HydrophobicContact CD2-CD2 4.37Å; L829-L844 HydrophobicContact CD2-CD1 4.35Å; I840-L844 HydrophobicContact CG2-CD1 3.71Å; I840-L844 HydrophobicContact CG2-CG 3.99Å; I840-L844 VanDerWaalsContact O-CB 3.27Å; I840-L844 WeakPolarHBondContact O-CB 3.43Å; I840-L844 WeakPolarHBondContact O-CG 3.45Å; I840-L844 PolarHBondContact O-N 3.41Å; L844-S848 VanDerWaalsContact O-CB 3.26Å; L844-S848 WeakPolarHBondContact O-CB 3.43Å; L844-S848 PolarHBondContact O-N 2.91Å; L844-S848 PolarHBondContact O-OG 2.61Å
845	T	81.1	Confident	77.1	Confident	23 Å²	23	42.3 Å²	42.3	14%	0.141	19%	0.194	C	C	.	.	H	α-helix	trans	-71.6	-44.3	176.2	-57.6	0	0	0	0	111.6	L841 Y842 Y843 C847 S848 V849 I934 T938	L841-T845 WeakPolarHBondContact O-CB 3.26Å; L841-T845 PolarHBondContact O-N 2.96Å; L841-T845 VanDerWaalsContact O-N 3.16Å; L841-T845 PolarHBondContact O-OG1 3.5Å; Y842-T845 CarbonylContact O-C 3.54Å; Y842-T845 WeakPolarHBondContact O-CA 3.3Å; Y842-T845 WeakPolarHBondContact O-CB 3.25Å; Y842-T845 PolarHBondContact O-N 3.43Å; Y842-T845 VanDerWaalsContact O-N 3.08Å; Y843-T845 PolarHBondContact O-N 3.06Å; T845-C847 VanDerWaalsContact C-N 3.32Å; T845-C847 PolarHBondContact O-N 3.4Å; T845-S848 PolarHBondContact O-N 3.35Å; T845-V849 WeakPolarHBondContact O-CG2 3.24Å; T845-V849 PolarHBondContact O-N 2.88Å; T845-I934 HydrophobicContact CG2-CG2 4.21Å; T845-T938 HydrophobicContact CG2-CG2 4.33Å; T845-T938 VanDerWaalsContact OG1-CG2 3.28Å; T845-T938 WeakPolarHBondContact OG1-CG2 3.45Å; T845-T938 PolarHBondContact OG1-OG1 3.18Å
846	R	76.2	Confident	77.4	Confident	68 Å²	68	41.8 Å²	41.8	26%	0.257	19%	0.192	S	C	.	.	H	α-helix	trans	-54.9	-47.1	173.3	-169.6	173	179.3	170.1	3.5	110.1	I510 D513 Y842 Y843 R850	I510-R846 HydrophobicContact CG2-CG 3.8Å; I510-R846 VanDerWaalsContact O-CZ 3.29Å; I510-R846 PolarHBondContact O-NE 2.92Å; I510-R846 PolarHBondContact O-NH2 3.36Å; D513-R846 IonicContact OD1-CZ 2.79Å; D513-R846 IonicContact OD1-NH1 2.99Å; D513-R846 PolarHBondContact OD1-NH1 3.45Å; D513-R846 IonicContact OD1-NH2 3.83Å; D513-R846 PolarHBondContact OD1-NH2 2.96Å; Y842-R846 PolarHBondContact O-N 3.15Å; Y843-R846 WeakPolarHBondContact O-CB 3.2Å; Y843-R846 PolarHBondContact O-N 3.05Å; Y843-R846 VanDerWaalsContact O-N 3.11Å; R846-R850 PolarHBondContact O-N 2.94Å
847	C	75	Confident	77.7	Confident	22 Å²	22	39.4 Å²	39.4	15%	0.149	18%	0.182	C	C	.	.	H	α-helix	trans	-71.6	-36.3	177.1	-65.7	0	0	0	0	114.1	I804 L809 Y843 T845 V849 R850 H851	I804-C847 HydrophobicContact CD1-CB 3.65Å; L809-C847 HydrophobicContact CD1-CB 4.34Å; L809-C847 HydrophobicContact CD2-CB 3.85Å; Y843-C847 WeakPolarHBondContact CE1-SG 3.37Å; Y843-C847 PolarHBondContact O-N 3.18Å; Y843-C847 PolarHBondContact O-SG 3.36Å; T845-C847 VanDerWaalsContact C-N 3.32Å; T845-C847 PolarHBondContact O-N 3.4Å; C847-V849 VanDerWaalsContact C-N 3.34Å; C847-R850 PolarHBondContact O-N 2.95Å; C847-H851 WeakPolarHBondContact O-CB 3.43Å; C847-H851 PolarHBondContact O-N 3.17Å
848	S	81.6	Confident	77.9	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-34.3	175.9	-60	0	0	0	0	112.2	L844 T845 H851 I852	L844-S848 VanDerWaalsContact O-CB 3.26Å; L844-S848 WeakPolarHBondContact O-CB 3.43Å; L844-S848 PolarHBondContact O-N 2.91Å; L844-S848 PolarHBondContact O-OG 2.61Å; T845-S848 PolarHBondContact O-N 3.35Å; S848-H851 PolarHBondContact O-N 2.99Å; S848-I852 WeakPolarHBondContact O-CG1 3.48Å; S848-I852 PolarHBondContact O-N 3.22Å; S848-I852 VanDerWaalsContact O-N 3.1Å
849	V	79.8	Confident	78	Confident	26 Å²	26	44.3 Å²	44.3	16%	0.158	21%	0.206	C	C	.	.	H	α-helix	trans	-67.9	-45.4	171.4	172.5	0	0	0	0	110.5	I510 T845 C847 H851 I852 L853 I931	I510-V849 HydrophobicContact CD1-CG1 3.94Å; T845-V849 WeakPolarHBondContact O-CG2 3.24Å; T845-V849 PolarHBondContact O-N 2.88Å; C847-V849 VanDerWaalsContact C-N 3.34Å; V849-H851 VanDerWaalsContact C-N 3.27Å; V849-H851 PolarHBondContact O-N 3.4Å; V849-I852 PolarHBondContact O-N 3.35Å; V849-L853 HydrophobicContact CG1-CD1 4.24Å; V849-L853 WeakPolarHBondContact O-CG 3.23Å; V849-L853 PolarHBondContact O-N 2.85Å; V849-I931 HydrophobicContact CG1-CD1 4.42Å; V849-I931 HydrophobicContact CG1-CG1 4.39Å; V849-I931 HydrophobicContact CG1-CG2 4.33Å; V849-I931 HydrophobicContact CG2-CG2 4.27Å
850	R	76.1	Confident	78.2	Confident	111 Å²	111	42.7 Å²	42.7	42%	0.419	19%	0.192	S	C	.	.	H	α-helix	trans	-55.8	-41.5	172.9	-174.1	173.8	179.7	174.3	2.1	112	I507 I510 R846 C847 L853 N854	I507-R850 HydrophobicContact CG1-CG 4.35Å; I507-R850 HydrophobicContact CG2-CG 4.03Å; I510-R850 HydrophobicContact CG2-CB 4.16Å; R846-R850 PolarHBondContact O-N 2.94Å; C847-R850 PolarHBondContact O-N 2.95Å; R850-L853 PolarHBondContact O-N 2.94Å; R850-N854 PolarHBondContact O-N 3.2Å; R850-N854 PolarHBondContact O-OD1 3.07Å
851	H	81.2	Confident	78.3	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.056	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-45.1	177.1	-164.5	41.1	0	0	0	112.6	E806 L809 S810 C847 S848 V849 L853 N854 L855	E806-H851 WeakPolarHBondContact CG-CE1 3.45Å; E806-H851 IonicContact OE1-CE1 3.61Å; E806-H851 PolarHBondContact OE1-CE1 3.38Å; L809-H851 HydrophobicContact CB-CB 4.04Å; L809-H851 VanDerWaalsContact CB-CD2 3.48Å; L809-H851 WeakPolarHBondContact CB-CD2 3.08Å; L809-H851 HydrophobicContact CD1-CB 4.22Å; S810-H851 WeakPolarHBondContact CA-NE2 3.46Å; S810-H851 WeakPolarHBondContact CB-NE2 3.44Å; S810-H851 PolarHBondContact N-NE2 3.41Å; S810-H851 PolarHBondContact OG-NE2 3.21Å; C847-H851 WeakPolarHBondContact O-CB 3.43Å; C847-H851 PolarHBondContact O-N 3.17Å; S848-H851 PolarHBondContact O-N 2.99Å; V849-H851 VanDerWaalsContact C-N 3.27Å; V849-H851 PolarHBondContact O-N 3.4Å; H851-L853 VanDerWaalsContact C-N 3.29Å; H851-L853 PolarHBondContact O-N 3.4Å; H851-N854 PolarHBondContact O-N 2.89Å; H851-L855 WeakPolarHBondContact O-CB 3.3Å; H851-L855 VanDerWaalsContact O-CG 3.31Å; H851-L855 WeakPolarHBondContact O-CG 3.48Å; H851-L855 PolarHBondContact O-N 3.02Å
852	I	82.5	Confident	78	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-40.5	174.2	-66.9	161.7	0	0	0	111.5	V813 S848 V849 H856 N930 I931 I934	V813-I852 HydrophobicContact CB-CG1 4.4Å; V813-I852 HydrophobicContact CG1-CD1 4.21Å; V813-I852 HydrophobicContact CG1-CG1 3.64Å; V813-I852 HydrophobicContact CG2-CD1 4.2Å; V813-I852 HydrophobicContact CG2-CG1 3.79Å; S848-I852 WeakPolarHBondContact O-CG1 3.48Å; S848-I852 PolarHBondContact O-N 3.22Å; S848-I852 VanDerWaalsContact O-N 3.1Å; V849-I852 PolarHBondContact O-N 3.35Å; I852-H856 WeakPolarHBondContact O-CB 3.48Å; I852-H856 PolarHBondContact O-N 3.21Å; I852-H856 VanDerWaalsContact O-N 3.1Å; I852-N930 HydrophobicContact CD1-CB 3.94Å; I852-N930 HydrophobicContact CG1-CB 4.4Å; I852-N930 HydrophobicContact CG2-CB 4.13Å; I852-I931 HydrophobicContact CB-CG1 4.19Å; I852-I931 HydrophobicContact CD1-CG1 4.04Å; I852-I931 HydrophobicContact CG2-CD1 4.23Å; I852-I931 HydrophobicContact CG2-CG1 3.81Å; I852-I934 HydrophobicContact CD1-CD1 3.49Å; I852-I934 VanDerWaalsContact CD1-CD1 3.49Å; I852-I934 HydrophobicContact CD1-CG1 4.16Å; I852-I934 HydrophobicContact CG1-CD1 4.46Å
853	L	79.1	Confident	77.5	Confident	5 Å²	5	42 Å²	42	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-44.8	179.3	-67	176.5	0	0	0	111.5	Y503 L506 I507 I510 V849 R850 H851 H856 I857 I931	Y503-L853 HydrophobicContact CD1-CD2 3.45Å; Y503-L853 VanDerWaalsContact CD1-CD2 3.45Å; Y503-L853 HydrophobicContact CE1-CD2 3.72Å; Y503-L853 HydrophobicContact CG-CD2 3.98Å; L506-L853 HydrophobicContact CB-CD1 4.28Å; I507-L853 HydrophobicContact CD1-CB 3.84Å; I507-L853 HydrophobicContact CG1-CB 3.86Å; I507-L853 HydrophobicContact CG1-CD1 4Å; I510-L853 HydrophobicContact CD1-CD1 4.07Å; V849-L853 HydrophobicContact CG1-CD1 4.24Å; V849-L853 WeakPolarHBondContact O-CG 3.23Å; V849-L853 PolarHBondContact O-N 2.85Å; R850-L853 PolarHBondContact O-N 2.94Å; H851-L853 VanDerWaalsContact C-N 3.29Å; H851-L853 PolarHBondContact O-N 3.4Å; L853-H856 PolarHBondContact O-N 2.85Å; L853-H856 VanDerWaalsContact O-N 3.14Å; L853-I857 WeakPolarHBondContact O-CG1 3.5Å; L853-I857 PolarHBondContact O-N 2.84Å; L853-I931 HydrophobicContact CD2-CD1 3.74Å; L853-I931 HydrophobicContact CG-CD1 4.25Å
854	N	78.6	Confident	76.9	Confident	72 Å²	72	41.4 Å²	41.4	39%	0.385	20%	0.2	S	C	.	.	H	α-helix	trans	-56.1	-54.4	173.1	-73.3	9.5	0	0	0	111.3	I507 R850 H851 H856 I857 E858	I507-N854 VanDerWaalsContact CD1-OD1 3.31Å; I507-N854 WeakPolarHBondContact CD1-OD1 3.48Å; R850-N854 PolarHBondContact O-N 3.2Å; R850-N854 PolarHBondContact O-OD1 3.07Å; H851-N854 PolarHBondContact O-N 2.89Å; N854-H856 PolarHBondContact O-N 3.44Å; N854-I857 PolarHBondContact O-N 3.43Å; N854-I857 VanDerWaalsContact O-N 3.12Å; N854-E858 PolarHBondContact O-N 3.26Å
855	L	81.6	Confident	76	Confident	48 Å²	48	46.8 Å²	46.8	25%	0.251	23%	0.225	S	C	.	.	H	α-helix	trans	-62.9	-9.4	177.9	-71.7	173.3	0	0	0	114.2	H851 K859	H851-L855 WeakPolarHBondContact O-CB 3.3Å; H851-L855 VanDerWaalsContact O-CG 3.31Å; H851-L855 WeakPolarHBondContact O-CG 3.48Å; H851-L855 PolarHBondContact O-N 3.02Å; L855-K859 WeakPolarHBondContact O-CD 3.15Å; L855-K859 WeakPolarHBondContact O-CE 3.48Å; L855-K859 WeakPolarHBondContact O-CG 3.36Å
856	H	79.3	Confident	74.8	Confident	11 Å²	11	49.2 Å²	49.2	5%	0.051	24%	0.243	C	C	.	.	H	α-helix	trans	-101.7	-35.1	173.6	-168.2	-110.5	0	0	0	112.2	Y503 I852 L853 N854 K859 L860 D923 T924 C927	Y503-H856 AromaticContact CD2-ND1 3.85Å; Y503-H856 AromaticContact CE2-CE1 3.8Å; Y503-H856 AromaticContact CE2-ND1 3.2Å; Y503-H856 WeakPolarHBondContact CE2-ND1 3.34Å; I852-H856 WeakPolarHBondContact O-CB 3.48Å; I852-H856 PolarHBondContact O-N 3.21Å; I852-H856 VanDerWaalsContact O-N 3.1Å; L853-H856 PolarHBondContact O-N 2.85Å; L853-H856 VanDerWaalsContact O-N 3.14Å; N854-H856 PolarHBondContact O-N 3.44Å; H856-K859 PolarHBondContact O-N 2.64Å; H856-L860 WeakPolarHBondContact O-CG 3.18Å; H856-L860 PolarHBondContact O-N 2.86Å; H856-D923 VanDerWaalsContact NE2-C 3.29Å; H856-D923 PolarHBondContact NE2-O 2.9Å; H856-T924 PolarHBondContact NE2-N 2.93Å; H856-C927 HydrophobicContact CB-CB 4.3Å
857	I	76.9	Confident	73.7	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.046	25%	0.245	C	C	.	.	H	α-helix	trans	-59.1	-49.4	169.1	-69.9	168.4	0	0	0	110.1	Y503 R504 I507 L853 N854 K859 L860 E861	Y503-I857 HydrophobicContact CD2-CG1 4.5Å; R504-I857 HydrophobicContact CG-CD1 4.03Å; I507-I857 HydrophobicContact CD1-CD1 3.44Å; I507-I857 VanDerWaalsContact CD1-CD1 3.44Å; L853-I857 WeakPolarHBondContact O-CG1 3.5Å; L853-I857 PolarHBondContact O-N 2.84Å; N854-I857 PolarHBondContact O-N 3.43Å; N854-I857 VanDerWaalsContact O-N 3.12Å; I857-K859 PolarHBondContact O-N 3.39Å; I857-K859 VanDerWaalsContact O-N 3.16Å; I857-L860 CarbonylContact O-C 3.41Å; I857-L860 WeakPolarHBondContact O-CA 3.34Å; I857-L860 WeakPolarHBondContact O-CB 3.41Å; I857-L860 PolarHBondContact O-N 3.28Å; I857-E861 HydrophobicContact CG2-CG 4.23Å; I857-E861 WeakPolarHBondContact O-CG 3.24Å; I857-E861 PolarHBondContact O-N 2.89Å
858	E	80.6	Confident	72.2	Confident	87 Å²	87	51.3 Å²	51.3	41%	0.407	27%	0.267	S	S	.	.	H	α-helix	trans	-55.3	-34.6	176.2	-177.7	-175.6	-153.7	0	0	112.4	N854 T862	N854-E858 PolarHBondContact O-N 3.26Å; E858-T862 WeakPolarHBondContact O-CG2 3.4Å; E858-T862 PolarHBondContact O-N 3.34Å; E858-T862 PolarHBondContact O-OG1 2.81Å
859	K	79.4	Confident	70.2	Confident	110 Å²	110	53.7 Å²	53.7	48%	0.478	29%	0.292	S	S	.	.	H	α-helix	trans	-77.7	-30.6	176.2	-71.2	176.1	-171.2	170	0	113.3	L855 H856 I857 T862 L863	L855-K859 WeakPolarHBondContact O-CD 3.15Å; L855-K859 WeakPolarHBondContact O-CE 3.48Å; L855-K859 WeakPolarHBondContact O-CG 3.36Å; H856-K859 PolarHBondContact O-N 2.64Å; I857-K859 PolarHBondContact O-N 3.39Å; I857-K859 VanDerWaalsContact O-N 3.16Å; K859-T862 WeakPolarHBondContact CA-OG1 3.27Å; K859-T862 PolarHBondContact O-OG1 2.95Å; K859-L863 VanDerWaalsContact O-CB 3.3Å; K859-L863 WeakPolarHBondContact O-CB 3.24Å; K859-L863 WeakPolarHBondContact O-CD1 3.43Å; K859-L863 WeakPolarHBondContact O-CG 3.41Å; K859-L863 PolarHBondContact O-N 3.27Å; K859-L863 VanDerWaalsContact O-N 3.11Å
860	L	72.4	Confident	68	Low	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-73.1	-37.2	171.3	-68.7	172.2	0	0	0	111.3	I499 Y503 H856 I857 L863 Q864 I920	I499-L860 HydrophobicContact CB-CD1 4.24Å; I499-L860 HydrophobicContact CG2-CD1 3.61Å; Y503-L860 HydrophobicContact CD2-CD1 4.3Å; Y503-L860 HydrophobicContact CE2-CD1 4.35Å; H856-L860 WeakPolarHBondContact O-CG 3.18Å; H856-L860 PolarHBondContact O-N 2.86Å; I857-L860 CarbonylContact O-C 3.41Å; I857-L860 WeakPolarHBondContact O-CA 3.34Å; I857-L860 WeakPolarHBondContact O-CB 3.41Å; I857-L860 PolarHBondContact O-N 3.28Å; L860-L863 PolarHBondContact O-N 3.45Å; L860-Q864 WeakPolarHBondContact O-CB 3.12Å; L860-Q864 PolarHBondContact O-N 3Å; L860-I920 HydrophobicContact CD2-CG1 4.34Å; L860-I920 HydrophobicContact CD2-CG2 4.06Å
861	E	74.1	Confident	65.7	Low	67 Å²	67	55.9 Å²	55.9	31%	0.313	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-50.7	175.6	-72	170	154	0	0	110.8	R504 I857 L863 Q864 E865	R504-E861 IonicContact CZ-OE1 3.59Å; R504-E861 IonicContact NH1-OE1 3.21Å; R504-E861 IonicContact NH2-OE1 2.93Å; R504-E861 PolarHBondContact NH2-OE1 3.21Å; I857-E861 HydrophobicContact CG2-CG 4.23Å; I857-E861 WeakPolarHBondContact O-CG 3.24Å; I857-E861 PolarHBondContact O-N 2.89Å; E861-L863 VanDerWaalsContact C-N 3.33Å; E861-L863 PolarHBondContact O-N 3.11Å; E861-Q864 CarbonylContact O-C 3.51Å; E861-Q864 WeakPolarHBondContact O-CA 3.31Å; E861-Q864 WeakPolarHBondContact O-CB 3.37Å; E861-Q864 PolarHBondContact O-N 3.12Å; E861-E865 WeakPolarHBondContact O-CG 3.35Å; E861-E865 PolarHBondContact O-N 3.08Å
862	T	75.2	Confident	63.4	Low	70 Å²	70	62.2 Å²	62.2	43%	0.429	36%	0.358	S	S	.	.	H	α-helix	trans	-65.3	-30.2	175.3	47.6	0	0	0	0	113.9	E858 K859 S866	E858-T862 WeakPolarHBondContact O-CG2 3.4Å; E858-T862 PolarHBondContact O-N 3.34Å; E858-T862 PolarHBondContact O-OG1 2.81Å; K859-T862 WeakPolarHBondContact CA-OG1 3.27Å; K859-T862 PolarHBondContact O-OG1 2.95Å; T862-S866 WeakPolarHBondContact O-CB 3.44Å; T862-S866 PolarHBondContact O-N 3.24Å; T862-S866 PolarHBondContact O-OG 3.45Å
863	L	66	Low	61.1	Low	36 Å²	36	68.3 Å²	68.3	19%	0.188	39%	0.39	C	S	.	.	H	α-helix	trans	-69.3	-33	168.8	-77.4	169.5	0	0	0	112.6	K859 L860 E861 S866 T867 T919 I920	K859-L863 VanDerWaalsContact O-CB 3.3Å; K859-L863 WeakPolarHBondContact O-CB 3.24Å; K859-L863 WeakPolarHBondContact O-CD1 3.43Å; K859-L863 WeakPolarHBondContact O-CG 3.41Å; K859-L863 PolarHBondContact O-N 3.27Å; K859-L863 VanDerWaalsContact O-N 3.11Å; L860-L863 PolarHBondContact O-N 3.45Å; E861-L863 VanDerWaalsContact C-N 3.33Å; E861-L863 PolarHBondContact O-N 3.11Å; L863-S866 WeakPolarHBondContact CA-OG 3.44Å; L863-S866 PolarHBondContact O-OG 3.37Å; L863-T867 WeakPolarHBondContact O-CB 3.46Å; L863-T867 PolarHBondContact O-N 2.95Å; L863-T867 VanDerWaalsContact O-N 3.12Å; L863-T867 PolarHBondContact O-OG1 2.67Å; L863-T919 HydrophobicContact CD1-CG2 3.83Å; L863-T919 HydrophobicContact CD2-CG2 3.79Å; L863-I920 HydrophobicContact CD1-CG1 4.32Å
864	Q	59.8	Low	58.9	Low	74 Å²	74	79.6 Å²	79.6	35%	0.346	43%	0.432	S	S	.	.	H	α-helix	trans	-72.2	-44.2	175	-178.9	171.1	-33.5	0	0	111.1	L860 E861 T867 S868	L860-Q864 WeakPolarHBondContact O-CB 3.12Å; L860-Q864 PolarHBondContact O-N 3Å; E861-Q864 CarbonylContact O-C 3.51Å; E861-Q864 WeakPolarHBondContact O-CA 3.31Å; E861-Q864 WeakPolarHBondContact O-CB 3.37Å; E861-Q864 PolarHBondContact O-N 3.12Å; Q864-T867 PolarHBondContact O-N 3.19Å; Q864-S868 WeakPolarHBondContact O-CB 3.45Å; Q864-S868 PolarHBondContact O-N 3.37Å; Q864-S868 PolarHBondContact O-OG 2.73Å
865	E	58.8	Low	56.6	Low	120 Å²	120	84.7 Å²	84.7	56%	0.561	45%	0.453	S	S	*	.	H	α-helix	trans	-60.1	-48.4	174.8	-71.8	-178.5	160.8	0	0	112.1	E861 T867 S868 G869	E861-E865 WeakPolarHBondContact O-CG 3.35Å; E861-E865 PolarHBondContact O-N 3.08Å; E865-T867 VanDerWaalsContact C-N 3.29Å; E865-T867 PolarHBondContact O-N 2.75Å; E865-S868 CarbonylContact O-C 3.6Å; E865-S868 PolarHBondContact O-N 2.86Å; E865-S868 VanDerWaalsContact O-N 3.1Å; E865-G869 PolarHBondContact O-N 3.3Å
866	S	56.5	Low	54.2	Low	75 Å²	75	86 Å²	86	52%	0.524	47%	0.467	S	S	.	.	H	α-helix	trans	-66	-29	177.5	52.3	0	0	0	0	113.3	T862 L863	T862-S866 WeakPolarHBondContact O-CB 3.44Å; T862-S866 PolarHBondContact O-N 3.24Å; T862-S866 PolarHBondContact O-OG 3.45Å; L863-S866 WeakPolarHBondContact CA-OG 3.44Å; L863-S866 PolarHBondContact O-OG 3.37Å
867	T	53.3	Low	51.9	Low	47 Å²	47	92.8 Å²	92.8	29%	0.288	50%	0.501	S	S	.	.	H	α-helix	trans	-70.9	-37.4	170.4	-58.3	0	0	0	0	111.8	L863 Q864 E865 T916	L863-T867 WeakPolarHBondContact O-CB 3.46Å; L863-T867 PolarHBondContact O-N 2.95Å; L863-T867 VanDerWaalsContact O-N 3.12Å; L863-T867 PolarHBondContact O-OG1 2.67Å; Q864-T867 PolarHBondContact O-N 3.19Å; E865-T867 VanDerWaalsContact C-N 3.29Å; E865-T867 PolarHBondContact O-N 2.75Å; T867-T916 WeakPolarHBondContact OG1-CG2 3.37Å
868	S	44.4	Very low	49.6	Very low	87 Å²	87	99.7 Å²	99.7	61%	0.608	54%	0.539	S	S	*	.	H	α-helix	trans	-79.8	-19.6	177.5	-66.8	0	0	0	0	114.4	Q864 E865	Q864-S868 WeakPolarHBondContact O-CB 3.45Å; Q864-S868 PolarHBondContact O-N 3.37Å; Q864-S868 PolarHBondContact O-OG 2.73Å; E865-S868 CarbonylContact O-C 3.6Å; E865-S868 PolarHBondContact O-N 2.86Å; E865-S868 VanDerWaalsContact O-N 3.1Å
869	G	38.7	Very low	47.1	Very low	53 Å²	53	102.3 Å²	102.3	55%	0.546	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.5	-4.3	179.1	0	0	0	0	0	115	E865 S871	E865-G869 PolarHBondContact O-N 3.3Å; G869-S871 VanDerWaalsContact C-N 3.28Å; G869-S871 PolarHBondContact O-N 2.98Å
870	S	34.4	Very low	44.7	Very low	90 Å²	90	104.1 Å²	104.1	63%	0.629	57%	0.569	S	S	*	*	S	Bend	trans	-77.2	67.1	-172.6	-177.3	0	0	0	0	114
871	S	27.8	Very low	42.8	Very low	93 Å²	93	109.6 Å²	109.6	65%	0.65	61%	0.607	S	S	*	*	S	Bend	trans	70.6	158.6	166.6	75.4	0	0	0	0	118.6	G869 L873	G869-S871 VanDerWaalsContact C-N 3.28Å; G869-S871 PolarHBondContact O-N 2.98Å; S871-L873 VanDerWaalsContact C-N 3.35Å; S871-L873 PolarHBondContact O-N 2.97Å
872	I	32.4	Very low	40.7	Very low	144 Å²	144	114.2 Å²	114.2	74%	0.738	63%	0.634	S	S	*	*	S	Bend	trans	72.3	-54.4	172.6	-56.8	166.9	0	0	0	115.9	R874 Q875	I872-R874 PolarHBondContact O-N 3.31Å; I872-Q875 PolarHBondContact O-N 3.49Å
873	L	33.8	Very low	38.8	Very low	134 Å²	134	116.1 Å²	116.1	70%	0.702	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-2.7	-164.6	-89.2	167.8	0	0	0	117.7	S871	S871-L873 VanDerWaalsContact C-N 3.35Å; S871-L873 PolarHBondContact O-N 2.97Å
874	R	33.6	Very low	37.3	Very low	243 Å²	243	123.8 Å²	123.8	92%	0.917	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	4.4	174	-83.9	-164.2	177.2	-147.3	2.5	114.8	I872	I872-R874 PolarHBondContact O-N 3.31Å
875	Q	30.3	Very low	36	Very low	179 Å²	179	129.1 Å²	129.1	84%	0.836	71%	0.71	S	S	*	*	S	Bend	trans	-114.7	-1.6	-175.8	-154.8	167.7	8.6	0	0	113.8	I872	I872-Q875 PolarHBondContact O-N 3.49Å
876	S	30.1	Very low	35.1	Very low	76 Å²	76	131.7 Å²	131.7	53%	0.531	73%	0.726	S	S	.	*	S	Bend	trans	-111.1	9	-175.3	58.8	0	0	0	0	114.7
877	I	31.8	Very low	34.1	Very low	152 Å²	152	135.7 Å²	135.7	78%	0.779	74%	0.741	S	S	*	*	S	Bend	trans	-127.5	58.2	175.4	-44.7	179.9	0	0	0	108.7
878	N	28.5	Very low	33.1	Very low	155 Å²	155	142 Å²	142	83%	0.829	77%	0.768	S	S	*	*			trans	-149.1	48.4	170.2	-164.6	32.3	0	0	0	110.5
879	I	29	Very low	32.4	Very low	142 Å²	142	142.7 Å²	142.7	73%	0.728	77%	0.772	S	S	*	*			trans	-142.3	142.3	173.8	-45.5	179	0	0	0	105.9
880	N	27.7	Very low	32.2	Very low	148 Å²	148	150.1 Å²	150.1	79%	0.791	79%	0.785	S	S	*	*			trans	72.5	79.1	-179	-54.3	-19.7	0	0	0	116.2
881	S	31.8	Very low	32.3	Very low	116 Å²	116	153.6 Å²	153.6	81%	0.811	80%	0.796	S	S	*	*	S	Bend	trans	-153.5	83.9	144.3	-73.9	0	0	0	0	108.9
882	D	30.6	Very low	32.5	Very low	165 Å²	165	158.7 Å²	158.7	88%	0.882	81%	0.809	S	S	*	*			trans	41.5	91.8	152.8	-50.3	-14.5	0	0	0	119.2
883	S	35.3	Very low	32.4	Very low	109 Å²	109	156.9 Å²	156.9	76%	0.762	81%	0.809	S	S	*	*			trans	-159	119.2	139.7	37.5	0	0	0	0	113
884	E	35.5	Very low	32.5	Very low	197 Å²	197	156 Å²	156	92%	0.921	82%	0.815	S	S	*	*			trans	62.2	163.9	145.4	-61.4	-178.7	167.3	0	0	121.3
885	E	32.8	Very low	32.3	Very low	187 Å²	187	148.4 Å²	148.4	87%	0.874	81%	0.812	S	S	*	*			trans	-71.6	145.6	-163	-55.2	164.8	130.5	0	0	113.8
886	I	39.3	Very low	32.4	Very low	174 Å²	174	145.2 Å²	145.2	89%	0.892	81%	0.809	S	S	*	*			trans	-160.8	148.9	146.7	-100.6	143.8	0	0	0	109.3
887	D	36.1	Very low	32.3	Very low	158 Å²	158	150 Å²	150	85%	0.845	82%	0.823	S	S	*	*			trans	-59.9	154.8	-157.5	-82.4	-62.3	0	0	0	118.9
888	E	30.5	Very low	32.4	Very low	181 Å²	181	150.5 Å²	150.5	85%	0.846	83%	0.825	S	S	*	*			trans	-65.5	175.9	158.7	-65.2	-169.6	113.9	0	0	112.6
889	S	31.4	Very low	32.4	Very low	100 Å²	100	152 Å²	152	70%	0.699	82%	0.821	S	S	*	*			trans	82.5	175.5	176.5	86.6	0	0	0	0	116.1
890	Y	34.4	Very low	32.3	Very low	210 Å²	210	152.9 Å²	152.9	82%	0.824	82%	0.822	S	S	*	*			trans	71.2	114.8	-166.1	-64.3	-81.1	0	0	0	117.1
891	L	35.2	Very low	32.4	Very low	163 Å²	163	151.1 Å²	151.1	85%	0.853	82%	0.821	S	S	*	*			trans	81	51.5	159.9	-51.4	-179.8	0	0	0	118.9
892	Q	31.7	Very low	32.2	Very low	199 Å²	199	152.1 Å²	152.1	93%	0.93	83%	0.828	S	S	*	*			trans	-62.2	126.4	130.8	-71.7	-177.8	-10.9	0	0	109.8
893	S	32.1	Very low	32	Very low	106 Å²	106	148.3 Å²	148.3	74%	0.741	81%	0.814	S	S	*	*			trans	-166.1	158.8	150	-161.3	0	0	0	0	112.2
894	S	34.3	Very low	31.9	Very low	117 Å²	117	152.6 Å²	152.6	82%	0.818	82%	0.819	S	S	*	*			trans	56.4	67.5	163.1	-61	0	0	0	0	117.8
895	G	29.1	Very low	31.6	Very low	83 Å²	83	150.9 Å²	150.9	86%	0.856	82%	0.815	S	S	*	*			trans	-82.1	148.7	160.7	0	0	0	0	0	113.1
896	S	33.3	Very low	31.5	Very low	112 Å²	112	146.9 Å²	146.9	78%	0.783	81%	0.805	S	S	*	*			trans	-149.1	134.7	163.6	65.9	0	0	0	0	111.7	I898	S896-I898 PolarHBondContact O-N 3.09Å
897	H	28.6	Very low	31.1	Very low	177 Å²	177	148.1 Å²	148.1	82%	0.819	81%	0.807	S	S	*	*			trans	-47.8	126.8	-178.3	-70.8	-104.5	0	0	0	115.1
898	I	32.1	Very low	30.7	Very low	161 Å²	161	144 Å²	144	83%	0.826	79%	0.791	S	S	*	*			trans	-136.8	106.1	144	-56.2	-177.7	0	0	0	108.8	S896	S896-I898 PolarHBondContact O-N 3.09Å
899	Y	28.8	Very low	30.6	Very low	187 Å²	187	143 Å²	143	73%	0.733	79%	0.791	S	S	*	*			trans	-90.6	145.1	163.1	-98.7	-100.1	0	0	0	109.4
900	H	27.8	Very low	30.7	Very low	161 Å²	161	145.8 Å²	145.8	75%	0.745	80%	0.798	S	S	*	*			trans	51.1	110.5	167.7	-58	-67.2	0	0	0	118.9
901	S	29.1	Very low	30.5	Very low	110 Å²	110	145.7 Å²	145.7	77%	0.769	80%	0.797	S	S	*	*				-168.4	103.8	127.5	-87.4	0	0	0	0	112.1	S903	S901-S903 VanDerWaalsContact C-N 3.27Å; S901-S903 PolarHBondContact O-N 3.29Å
902	S	27.9	Very low	30.8	Very low	138 Å²	138	141.5 Å²	141.5	97%	0.965	78%	0.78	S	S	*	*			trans	-75.4	71.3	176.2	-51.6	0	0	0	0	111.8
903	S	27.3	Very low	31.2	Very low	84 Å²	84	134.7 Å²	134.7	59%	0.587	75%	0.754	S	S	*	*			trans	-152.5	148.6	173.4	80.7	0	0	0	0	113.2	S901	S901-S903 VanDerWaalsContact C-N 3.27Å; S901-S903 PolarHBondContact O-N 3.29Å
904	K	31.6	Very low	32.1	Very low	199 Å²	199	135.4 Å²	135.4	87%	0.865	75%	0.75	S	S	*	*			trans	65.4	58.2	167	-52.9	174.9	-174.3	172.5	0	117.1
905	L	30.2	Very low	33.2	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	73%	0.733	S	S	*	*			trans	-65	134.4	141.8	-90.7	157.3	0	0	0	108.4	Q907	L905-Q907 PolarHBondContact O-N 3.25Å
906	P	30.7	Very low	34.6	Very low	102 Å²	102	130.4 Å²	130.4	66%	0.662	70%	0.7	S	S	*	*			trans	-72.7	119.6	-176.1	27.9	-33.3	0	0	0	111.2	S908	P906-S908 PolarHBondContact O-N 3.3Å
907	Q	30.9	Very low	35.5	Very low	200 Å²	200	128.6 Å²	128.6	94%	0.935	68%	0.677	S	S	*	*			trans	-77.4	38.6	-179.5	-62.1	-179.3	-64.4	0	0	113.4	L905	L905-Q907 PolarHBondContact O-N 3.25Å
908	S	27	Very low	37.3	Very low	72 Å²	72	126.4 Å²	126.4	50%	0.503	67%	0.667	S	S	.	*			trans	-97.2	139.2	178	47.8	0	0	0	0	111.3	P906	P906-S908 PolarHBondContact O-N 3.3Å
909	N	29.8	Very low	39.1	Very low	160 Å²	160	120 Å²	120	86%	0.856	64%	0.636	S	S	*	*	S	Bend	trans	83.8	6.9	167.5	-48.5	-12.7	0	0	0	118.5
910	L	31.7	Very low	40.9	Very low	159 Å²	159	111.3 Å²	111.3	83%	0.832	60%	0.602	S	S	*	*			trans	-95.3	19.2	178.1	-107.9	165.9	0	0	0	115.6
911	Y	31.2	Very low	42.9	Very low	208 Å²	208	108.9 Å²	108.9	82%	0.816	59%	0.593	S	S	*	*	S	Bend	trans	-94.3	120.9	171.8	-85.2	-86.2	0	0	0	110.8	S913	Y911-S913 PolarHBondContact O-N 3.2Å
912	P	40.7	Very low	44.9	Very low	75 Å²	75	110.9 Å²	110.9	49%	0.487	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-61.9	121.8	165.9	27	-32.4	0	0	0	108.4	T492 N914	T492-P912 HydrophobicContact CG2-CB 4.42Å; P912-N914 PolarHBondContact O-N 3.16Å
913	S	40.2	Very low	47	Very low	56 Å²	56	106 Å²	106	39%	0.392	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-61.5	132.2	-168.4	78.2	0	0	0	0	112	Y911 S915 T916	Y911-S913 PolarHBondContact O-N 3.2Å; S913-S915 VanDerWaalsContact CB-OG 3.3Å; S913-S915 WeakPolarHBondContact CB-OG 3.26Å; S913-S915 PolarHBondContact O-N 3.24Å; S913-S915 PolarHBondContact OG-OG 2.85Å; S913-T916 PolarHBondContact O-N 3.13Å; S913-T916 PolarHBondContact OG-OG1 2.87Å
914	N	51.2	Low	49	Very low	121 Å²	121	103.7 Å²	103.7	65%	0.647	53%	0.529	S	S	*	.	H	α-helix	trans	-52.2	-33.1	177.8	-77.4	-6.6	0	0	0	111.9	P912 T916 Y917 E918	P912-N914 PolarHBondContact O-N 3.16Å; N914-T916 VanDerWaalsContact C-N 3.29Å; N914-T916 PolarHBondContact O-N 3.07Å; N914-Y917 PolarHBondContact O-N 3.42Å; N914-Y917 VanDerWaalsContact O-N 3.11Å; N914-E918 WeakPolarHBondContact O-CB 3.45Å; N914-E918 WeakPolarHBondContact O-CG 3.5Å; N914-E918 PolarHBondContact O-N 3.37Å
915	S	56.9	Low	50.7	Low	68 Å²	68	95.5 Å²	95.5	48%	0.476	50%	0.502	S	S	.	.	H	α-helix	trans	-52.3	-38.1	174.7	24.9	0	0	0	0	114.6	S913 T919	S913-S915 VanDerWaalsContact CB-OG 3.3Å; S913-S915 WeakPolarHBondContact CB-OG 3.26Å; S913-S915 PolarHBondContact O-N 3.24Å; S913-S915 PolarHBondContact OG-OG 2.85Å; S915-T919 WeakPolarHBondContact O-CB 3.16Å; S915-T919 PolarHBondContact O-N 3.41Å; S915-T919 PolarHBondContact O-OG1 2.98Å
916	T	59	Low	52.9	Low	26 Å²	26	92.6 Å²	92.6	16%	0.16	48%	0.484	C	S	.	.	H	α-helix	trans	-69.8	-42.7	177.9	-51.8	0	0	0	0	110.6	T492 T867 S913 N914 T919 I920	T492-T916 HydrophobicContact CG2-CG2 3.96Å; T867-T916 WeakPolarHBondContact OG1-CG2 3.37Å; S913-T916 PolarHBondContact O-N 3.13Å; S913-T916 PolarHBondContact OG-OG1 2.87Å; N914-T916 VanDerWaalsContact C-N 3.29Å; N914-T916 PolarHBondContact O-N 3.07Å; T916-T919 WeakPolarHBondContact O-CB 3.42Å; T916-T919 PolarHBondContact O-N 3.11Å; T916-I920 HydrophobicContact CG2-CD1 4.25Å; T916-I920 WeakPolarHBondContact O-CG1 3.25Å; T916-I920 PolarHBondContact O-N 3.33Å
917	Y	53.2	Low	55	Low	74 Å²	74	87.9 Å²	87.9	29%	0.29	45%	0.453	S	S	.	.	H	α-helix	trans	-71.2	-41.5	-179.2	-137.4	-74.3	0	0	0	112.1	L491 T492 V495 N914 T919 I920 I921	L491-Y917 HydrophobicContact CB-CE2 4.28Å; L491-Y917 HydrophobicContact CD2-CE2 4.13Å; L491-Y917 HydrophobicContact CG-CE2 4.49Å; T492-Y917 HydrophobicContact CG2-CD2 3.76Å; T492-Y917 HydrophobicContact CG2-CE2 4.44Å; V495-Y917 WeakPolarHBondContact CG2-OH 3.28Å; N914-Y917 PolarHBondContact O-N 3.42Å; N914-Y917 VanDerWaalsContact O-N 3.11Å; Y917-T919 VanDerWaalsContact C-N 3.29Å; Y917-T919 PolarHBondContact O-N 2.85Å; Y917-I920 PolarHBondContact O-N 3.31Å; Y917-I921 HydrophobicContact CD1-CD1 3.81Å; Y917-I921 HydrophobicContact CD1-CG1 4.32Å; Y917-I921 HydrophobicContact CE1-CD1 4.18Å; Y917-I921 WeakPolarHBondContact O-CG1 3.24Å; Y917-I921 PolarHBondContact O-N 2.99Å
918	E	65	Low	57	Low	131 Å²	131	86 Å²	86	61%	0.612	44%	0.438	S	S	*	.	H	α-helix	trans	-60.7	-38.2	170.8	-74	179.7	-175.2	0	0	111.6	N914 R922	N914-E918 WeakPolarHBondContact O-CB 3.45Å; N914-E918 WeakPolarHBondContact O-CG 3.5Å; N914-E918 PolarHBondContact O-N 3.37Å; E918-R922 WeakPolarHBondContact O-CB 3.38Å; E918-R922 PolarHBondContact O-N 3.37Å
919	T	69.8	Low	59.3	Low	27 Å²	27	83.7 Å²	83.7	17%	0.166	42%	0.423	C	S	.	.	H	α-helix	trans	-64.9	-49.4	175.6	-69.4	0	0	0	0	111.6	L863 S915 T916 Y917 I921 R922 D923	L863-T919 HydrophobicContact CD1-CG2 3.83Å; L863-T919 HydrophobicContact CD2-CG2 3.79Å; S915-T919 WeakPolarHBondContact O-CB 3.16Å; S915-T919 PolarHBondContact O-N 3.41Å; S915-T919 PolarHBondContact O-OG1 2.98Å; T916-T919 WeakPolarHBondContact O-CB 3.42Å; T916-T919 PolarHBondContact O-N 3.11Å; Y917-T919 VanDerWaalsContact C-N 3.29Å; Y917-T919 PolarHBondContact O-N 2.85Å; T919-I921 VanDerWaalsContact C-N 3.32Å; T919-I921 PolarHBondContact O-N 3.46Å; T919-R922 PolarHBondContact O-N 3.46Å; T919-D923 WeakPolarHBondContact CG2-OD2 3.31Å; T919-D923 WeakPolarHBondContact O-CB 3.18Å; T919-D923 PolarHBondContact O-N 3.05Å
920	I	67.7	Low	61.6	Low	5 Å²	5	77.7 Å²	77.7	3%	0.026	39%	0.39	C	S	.	.	H	α-helix	trans	-57.1	-45.2	176.1	-68.3	163.5	0	0	0	110.9	A496 I499 L860 L863 T916 Y917 T924	A496-I920 HydrophobicContact CB-CD1 4.28Å; I499-I920 HydrophobicContact CD1-CG2 4.01Å; L860-I920 HydrophobicContact CD2-CG1 4.34Å; L860-I920 HydrophobicContact CD2-CG2 4.06Å; L863-I920 HydrophobicContact CD1-CG1 4.32Å; T916-I920 HydrophobicContact CG2-CD1 4.25Å; T916-I920 WeakPolarHBondContact O-CG1 3.25Å; T916-I920 PolarHBondContact O-N 3.33Å; Y917-I920 PolarHBondContact O-N 3.31Å; I920-T924 WeakPolarHBondContact O-CB 3.12Å; I920-T924 PolarHBondContact O-N 2.88Å; I920-T924 PolarHBondContact O-OG1 3.11Å
921	I	69.2	Low	64	Low	110 Å²	110	72.1 Å²	72.1	56%	0.564	36%	0.361	S	S	*	.	H	α-helix	trans	-65.8	-46	178.4	-69.1	171.3	0	0	0	111.6	Y917 T919 D923 G925	Y917-I921 HydrophobicContact CD1-CD1 3.81Å; Y917-I921 HydrophobicContact CD1-CG1 4.32Å; Y917-I921 HydrophobicContact CE1-CD1 4.18Å; Y917-I921 WeakPolarHBondContact O-CG1 3.24Å; Y917-I921 PolarHBondContact O-N 2.99Å; T919-I921 VanDerWaalsContact C-N 3.32Å; T919-I921 PolarHBondContact O-N 3.46Å; I921-D923 PolarHBondContact O-N 3.46Å; I921-G925 PolarHBondContact O-N 3.23Å
922	R	71.4	Confident	66.2	Low	151 Å²	151	63.3 Å²	63.3	57%	0.57	33%	0.333	S	S	*	.	H	α-helix	trans	-59.9	-45.8	178.7	-178.6	-166.9	70.3	-148.6	-5.5	111.3	E918 T919 G925 Q926	E918-R922 WeakPolarHBondContact O-CB 3.38Å; E918-R922 PolarHBondContact O-N 3.37Å; T919-R922 PolarHBondContact O-N 3.46Å; R922-G925 CarbonylContact O-C 3.5Å; R922-G925 WeakPolarHBondContact O-CA 3.42Å; R922-G925 PolarHBondContact O-N 2.76Å; R922-G925 VanDerWaalsContact O-N 3.16Å; R922-Q926 PolarHBondContact O-N 2.87Å
923	D	71.3	Confident	68.4	Low	37 Å²	37	62.4 Å²	62.4	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-77.8	-33.4	-173	-62.9	-6.4	0	0	0	110.6	H856 T919 I921 G925 Q926 C927	H856-D923 VanDerWaalsContact NE2-C 3.29Å; H856-D923 PolarHBondContact NE2-O 2.9Å; T919-D923 WeakPolarHBondContact CG2-OD2 3.31Å; T919-D923 WeakPolarHBondContact O-CB 3.18Å; T919-D923 PolarHBondContact O-N 3.05Å; I921-D923 PolarHBondContact O-N 3.46Å; D923-G925 VanDerWaalsContact C-N 3.31Å; D923-G925 PolarHBondContact O-N 3.02Å; D923-Q926 WeakPolarHBondContact O-CB 3.38Å; D923-Q926 PolarHBondContact O-N 2.89Å; D923-C927 WeakPolarHBondContact O-CB 3.15Å; D923-C927 PolarHBondContact O-N 2.73Å
924	T	70.6	Confident	70.6	Confident	34 Å²	34	59.9 Å²	59.9	21%	0.209	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-42	164.3	-61.2	0	0	0	0	111.5	H856 I920 C927 R928	H856-T924 PolarHBondContact NE2-N 2.93Å; I920-T924 WeakPolarHBondContact O-CB 3.12Å; I920-T924 PolarHBondContact O-N 2.88Å; I920-T924 PolarHBondContact O-OG1 3.11Å; T924-C927 WeakPolarHBondContact O-CB 3.42Å; T924-C927 PolarHBondContact O-N 2.89Å; T924-R928 PolarHBondContact O-N 2.77Å
925	G	67.4	Low	72.2	Confident	28 Å²	28	57.5 Å²	57.5	29%	0.289	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-41	172.4	0	0	0	0	0	113	I921 R922 D923 R928 A929	I921-G925 PolarHBondContact O-N 3.23Å; R922-G925 CarbonylContact O-C 3.5Å; R922-G925 WeakPolarHBondContact O-CA 3.42Å; R922-G925 PolarHBondContact O-N 2.76Å; R922-G925 VanDerWaalsContact O-N 3.16Å; D923-G925 VanDerWaalsContact C-N 3.31Å; D923-G925 PolarHBondContact O-N 3.02Å; G925-R928 PolarHBondContact O-N 3.07Å; G925-A929 WeakPolarHBondContact O-CB 3.42Å; G925-A929 PolarHBondContact O-N 3.08Å
926	Q	75.5	Confident	73.6	Confident	100 Å²	100	55.4 Å²	55.4	47%	0.467	27%	0.27	S	S	.	.	H	α-helix	trans	-67.6	-37.6	176	-174.3	60.7	36.6	0	0	112.2	R922 D923 A929 N930	R922-Q926 PolarHBondContact O-N 2.87Å; D923-Q926 WeakPolarHBondContact O-CB 3.38Å; D923-Q926 PolarHBondContact O-N 2.89Å; Q926-A929 PolarHBondContact O-N 2.99Å; Q926-N930 PolarHBondContact NE2-OD1 3.23Å; Q926-N930 VanDerWaalsContact NE2-OD1 3.08Å; Q926-N930 WeakPolarHBondContact O-CB 3.02Å; Q926-N930 PolarHBondContact O-N 3.08Å
927	C	74.9	Confident	75.1	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.02	27%	0.269	C	S	.	.	H	α-helix	trans	-59.6	-53	171.4	-178.3	0	0	0	0	111	H856 D923 T924 A929 N930 I931	H856-C927 HydrophobicContact CB-CB 4.3Å; D923-C927 WeakPolarHBondContact O-CB 3.15Å; D923-C927 PolarHBondContact O-N 2.73Å; T924-C927 WeakPolarHBondContact O-CB 3.42Å; T924-C927 PolarHBondContact O-N 2.89Å; C927-A929 VanDerWaalsContact C-N 3.26Å; C927-A929 PolarHBondContact O-N 3.42Å; C927-N930 PolarHBondContact O-N 3Å; C927-N930 VanDerWaalsContact O-N 3.12Å; C927-I931 WeakPolarHBondContact O-CG1 3.48Å; C927-I931 PolarHBondContact O-N 3.4Å
928	R	73.1	Confident	76.7	Confident	162 Å²	162	53.1 Å²	53.1	61%	0.611	26%	0.26	S	S	*	.	H	α-helix	trans	-54.5	-40.5	174.1	-171.4	-178.7	-177.8	-159.9	0.9	111.8	E369 T924 G925 G932	E369-R928 IonicContact OE2-CZ 2.31Å; E369-R928 IonicContact OE2-NH1 3.14Å; E369-R928 PolarHBondContact OE2-NH1 2.83Å; E369-R928 IonicContact OE2-NH2 2.74Å; E369-R928 PolarHBondContact OE2-NH2 3.35Å; T924-R928 PolarHBondContact O-N 2.77Å; G925-R928 PolarHBondContact O-N 3.07Å; R928-G932 PolarHBondContact O-N 3.32Å
929	A	76	Confident	77.8	Confident	23 Å²	23	49.5 Å²	49.5	19%	0.19	24%	0.244	C	C	.	.	H	α-helix	trans	-71.3	-36.8	177.9	0	0	0	0	0	113.6	Y374 G925 Q926 C927 R933	Y374-A929 HydrophobicContact CD1-CB 4.39Å; Y374-A929 HydrophobicContact CE1-CB 4.33Å; G925-A929 WeakPolarHBondContact O-CB 3.42Å; G925-A929 PolarHBondContact O-N 3.08Å; Q926-A929 PolarHBondContact O-N 2.99Å; C927-A929 VanDerWaalsContact C-N 3.26Å; C927-A929 PolarHBondContact O-N 3.42Å; A929-R933 WeakPolarHBondContact O-CB 3.4Å; A929-R933 PolarHBondContact O-N 3.04Å
930	N	78.5	Confident	78.7	Confident	33 Å²	33	49.5 Å²	49.5	18%	0.176	25%	0.245	C	C	.	.	H	α-helix	trans	-66.6	-47.8	174.5	-76.5	-12.6	0	0	0	111.1	I852 Q926 C927 G932 R933 I934	I852-N930 HydrophobicContact CD1-CB 3.94Å; I852-N930 HydrophobicContact CG1-CB 4.4Å; I852-N930 HydrophobicContact CG2-CB 4.13Å; Q926-N930 PolarHBondContact NE2-OD1 3.23Å; Q926-N930 VanDerWaalsContact NE2-OD1 3.08Å; Q926-N930 WeakPolarHBondContact O-CB 3.02Å; Q926-N930 PolarHBondContact O-N 3.08Å; C927-N930 PolarHBondContact O-N 3Å; C927-N930 VanDerWaalsContact O-N 3.12Å; N930-G932 VanDerWaalsContact C-N 3.32Å; N930-G932 PolarHBondContact O-N 2.83Å; N930-R933 WeakPolarHBondContact O-CB 3.49Å; N930-R933 PolarHBondContact O-N 2.96Å; N930-R933 VanDerWaalsContact O-N 3.13Å; N930-R933 VanDerWaalsContact OD1-CZ 3.3Å; N930-R933 PolarHBondContact OD1-NH1 2.98Å; N930-R933 PolarHBondContact OD1-NH2 2.85Å; N930-I934 PolarHBondContact O-N 3.11Å
931	I	81.4	Confident	79.7	Confident	42 Å²	42	49.3 Å²	49.3	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-44.1	176.1	-66.5	169.7	0	0	0	110.4	V849 I852 L853 C927 R933 I934 K935	V849-I931 HydrophobicContact CG1-CD1 4.42Å; V849-I931 HydrophobicContact CG1-CG1 4.39Å; V849-I931 HydrophobicContact CG1-CG2 4.33Å; V849-I931 HydrophobicContact CG2-CG2 4.27Å; I852-I931 HydrophobicContact CB-CG1 4.19Å; I852-I931 HydrophobicContact CD1-CG1 4.04Å; I852-I931 HydrophobicContact CG2-CD1 4.23Å; I852-I931 HydrophobicContact CG2-CG1 3.81Å; L853-I931 HydrophobicContact CD2-CD1 3.74Å; L853-I931 HydrophobicContact CG-CD1 4.25Å; C927-I931 WeakPolarHBondContact O-CG1 3.48Å; C927-I931 PolarHBondContact O-N 3.4Å; I931-R933 VanDerWaalsContact C-N 3.34Å; I931-R933 PolarHBondContact O-N 3.05Å; I931-I934 PolarHBondContact O-N 2.65Å; I931-K935 WeakPolarHBondContact O-CB 3.38Å; I931-K935 PolarHBondContact O-N 3.02Å
932	G	77.7	Confident	80.7	Confident	23 Å²	23	45.5 Å²	45.5	24%	0.237	22%	0.223	C	C	.	.	H	α-helix	trans	-57.5	-43.1	173.5	0	0	0	0	0	113.1	R928 N930 D936	R928-G932 PolarHBondContact O-N 3.32Å; N930-G932 VanDerWaalsContact C-N 3.32Å; N930-G932 PolarHBondContact O-N 2.83Å; G932-D936 WeakPolarHBondContact O-CB 3.43Å; G932-D936 PolarHBondContact O-N 2.92Å
933	R	86.7	Confident	81.4	Confident	56 Å²	56	41.1 Å²	41.1	21%	0.211	21%	0.213	C	C	.	.	H	α-helix	trans	-62	-50	178.2	-168.1	-170	-49.9	116.7	16.5	112	H815 A929 N930 I931 D936 Y937	H815-R933 WeakPolarHBondContact O-CD 3.45Å; A929-R933 WeakPolarHBondContact O-CB 3.4Å; A929-R933 PolarHBondContact O-N 3.04Å; N930-R933 WeakPolarHBondContact O-CB 3.49Å; N930-R933 PolarHBondContact O-N 2.96Å; N930-R933 VanDerWaalsContact O-N 3.13Å; N930-R933 VanDerWaalsContact OD1-CZ 3.3Å; N930-R933 PolarHBondContact OD1-NH1 2.98Å; N930-R933 PolarHBondContact OD1-NH2 2.85Å; I931-R933 VanDerWaalsContact C-N 3.34Å; I931-R933 PolarHBondContact O-N 3.05Å; R933-D936 PolarHBondContact O-N 3.3Å; R933-Y937 HydrophobicContact CG-CD1 4.04Å; R933-Y937 HydrophobicContact CG-CD2 4.27Å; R933-Y937 HydrophobicContact CG-CE1 3.62Å; R933-Y937 HydrophobicContact CG-CE2 3.9Å; R933-Y937 HydrophobicContact CG-CG 4.36Å; R933-Y937 VanDerWaalsContact O-CB 3.31Å; R933-Y937 WeakPolarHBondContact O-CB 3.45Å; R933-Y937 WeakPolarHBondContact O-CD1 3.46Å; R933-Y937 VanDerWaalsContact O-CG 3.25Å; R933-Y937 PolarHBondContact O-N 2.63Å
934	I	85.7	Confident	82.2	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-62.9	-46.1	-179.8	-62.5	-169.4	0	0	0	110.7	V813 T845 I852 N930 I931 D936 Y937 T938	V813-I934 HydrophobicContact CB-CD1 4.26Å; V813-I934 HydrophobicContact CG2-CD1 3.67Å; T845-I934 HydrophobicContact CG2-CG2 4.21Å; I852-I934 HydrophobicContact CD1-CD1 3.49Å; I852-I934 VanDerWaalsContact CD1-CD1 3.49Å; I852-I934 HydrophobicContact CD1-CG1 4.16Å; I852-I934 HydrophobicContact CG1-CD1 4.46Å; N930-I934 PolarHBondContact O-N 3.11Å; I931-I934 PolarHBondContact O-N 2.65Å; I934-D936 PolarHBondContact O-N 3.47Å; I934-Y937 PolarHBondContact O-N 3.12Å; I934-Y937 VanDerWaalsContact O-N 3.13Å; I934-T938 PolarHBondContact O-N 3.01Å; I934-T938 PolarHBondContact O-OG1 3.03Å
935	K	85.7	Confident	83.1	Confident	70 Å²	70	48.3 Å²	48.3	30%	0.304	23%	0.233	S	C	.	.	H	α-helix	trans	-54.1	-50.8	175.4	-178.3	-164.9	70.3	-177.5	0	111.6	I931 Y937 I939	I931-K935 WeakPolarHBondContact O-CB 3.38Å; I931-K935 PolarHBondContact O-N 3.02Å; K935-Y937 VanDerWaalsContact C-N 3.3Å; K935-Y937 PolarHBondContact O-N 3.08Å; K935-I939 HydrophobicContact CG-CD1 3.88Å; K935-I939 WeakPolarHBondContact O-CB 3.32Å; K935-I939 VanDerWaalsContact O-CG1 3.24Å; K935-I939 WeakPolarHBondContact O-CG1 3.43Å; K935-I939 PolarHBondContact O-N 2.89Å
936	D	85.9	Confident	84	Confident	25 Å²	25	47 Å²	47	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-66.4	-31.7	180	-81.7	20.7	0	0	0	112.2	G932 R933 I934 T940	G932-D936 WeakPolarHBondContact O-CB 3.43Å; G932-D936 PolarHBondContact O-N 2.92Å; R933-D936 PolarHBondContact O-N 3.3Å; I934-D936 PolarHBondContact O-N 3.47Å; D936-T940 VanDerWaalsContact O-CB 3.23Å; D936-T940 WeakPolarHBondContact O-CB 3.37Å; D936-T940 PolarHBondContact O-N 3.32Å; D936-T940 PolarHBondContact O-OG1 3.2Å
937	Y	90.7	Very high	84.5	Confident	34 Å²	34	43.4 Å²	43.4	13%	0.133	21%	0.208	C	C	.	.	H	α-helix	trans	-72.4	-49.6	176.9	-77.8	18.3	0	0	0	111.6	H815 T816 N817 Y818 F821 R933 I934 K935 I939 T940 F941	H815-Y937 HydrophobicContact CB-CE2 4.3Å; T816-Y937 VanDerWaalsContact C-OH 3.26Å; T816-Y937 PolarHBondContact O-OH 3.35Å; N817-Y937 PolarHBondContact N-OH 3.1Å; Y818-Y937 AromaticContact CD2-CD1 3.95Å; Y818-Y937 HydrophobicContact CD2-CD1 3.95Å; Y818-Y937 HydrophobicContact CD2-CD2 4.33Å; Y818-Y937 HydrophobicContact CD2-CE1 4.45Å; Y818-Y937 AromaticContact CD2-CG 3.87Å; Y818-Y937 HydrophobicContact CD2-CG 3.87Å; Y818-Y937 HydrophobicContact CG-CD1 4.5Å; Y818-Y937 PolarHBondContact N-OH 2.81Å; Y818-Y937 VanDerWaalsContact N-OH 3.13Å; F821-Y937 HydrophobicContact CB-CD2 3.71Å; F821-Y937 HydrophobicContact CB-CE2 4.21Å; F821-Y937 HydrophobicContact CD1-CD2 4.23Å; F821-Y937 HydrophobicContact CD1-CG 4.44Å; F821-Y937 AromaticContact CD2-CD2 3.88Å; F821-Y937 HydrophobicContact CD2-CD2 3.88Å; F821-Y937 AromaticContact CG-CD2 3.69Å; F821-Y937 HydrophobicContact CG-CD2 3.69Å; F821-Y937 HydrophobicContact CG-CG 4.32Å; R933-Y937 HydrophobicContact CG-CD1 4.04Å; R933-Y937 HydrophobicContact CG-CD2 4.27Å; R933-Y937 HydrophobicContact CG-CE1 3.62Å; R933-Y937 HydrophobicContact CG-CE2 3.9Å; R933-Y937 HydrophobicContact CG-CG 4.36Å; R933-Y937 VanDerWaalsContact O-CB 3.31Å; R933-Y937 WeakPolarHBondContact O-CB 3.45Å; R933-Y937 WeakPolarHBondContact O-CD1 3.46Å; R933-Y937 VanDerWaalsContact O-CG 3.25Å; R933-Y937 PolarHBondContact O-N 2.63Å; I934-Y937 PolarHBondContact O-N 3.12Å; I934-Y937 VanDerWaalsContact O-N 3.13Å; K935-Y937 VanDerWaalsContact C-N 3.3Å; K935-Y937 PolarHBondContact O-N 3.08Å; Y937-I939 VanDerWaalsContact C-N 3.35Å; Y937-I939 PolarHBondContact O-N 3.3Å; Y937-T940 PolarHBondContact O-N 3.29Å; Y937-F941 WeakPolarHBondContact O-CB 3.38Å; Y937-F941 PolarHBondContact O-N 3.26Å
938	T	87.6	Confident	84.9	Confident	18 Å²	18	46.7 Å²	46.7	11%	0.11	23%	0.225	C	C	.	.	H	α-helix	trans	-57	-46	173.2	-66.5	0	0	0	0	111.3	L841 T845 I934 T940 F941 F942	L841-T938 HydrophobicContact CD1-CG2 4.16Å; L841-T938 HydrophobicContact CD2-CG2 4.33Å; L841-T938 HydrophobicContact CG-CG2 3.99Å; T845-T938 HydrophobicContact CG2-CG2 4.33Å; T845-T938 VanDerWaalsContact OG1-CG2 3.28Å; T845-T938 WeakPolarHBondContact OG1-CG2 3.45Å; T845-T938 PolarHBondContact OG1-OG1 3.18Å; I934-T938 PolarHBondContact O-N 3.01Å; I934-T938 PolarHBondContact O-OG1 3.03Å; T938-T940 PolarHBondContact O-N 3.11Å; T938-F941 PolarHBondContact O-N 2.82Å; T938-F942 WeakPolarHBondContact O-CB 3.4Å; T938-F942 PolarHBondContact O-N 2.89Å
939	I	87.1	Confident	85.6	Confident	54 Å²	54	41.4 Å²	41.4	28%	0.277	21%	0.205	S	C	.	.	H	α-helix	trans	-64.5	-41.2	176.9	-69.1	170.7	0	0	0	111	K935 Y937 F941 T943	K935-I939 HydrophobicContact CG-CD1 3.88Å; K935-I939 WeakPolarHBondContact O-CB 3.32Å; K935-I939 VanDerWaalsContact O-CG1 3.24Å; K935-I939 WeakPolarHBondContact O-CG1 3.43Å; K935-I939 PolarHBondContact O-N 2.89Å; Y937-I939 VanDerWaalsContact C-N 3.35Å; Y937-I939 PolarHBondContact O-N 3.3Å; I939-F941 VanDerWaalsContact C-N 3.35Å; I939-T943 HydrophobicContact CG2-CG2 4.22Å; I939-T943 WeakPolarHBondContact O-CB 3.43Å; I939-T943 VanDerWaalsContact O-CG2 3.29Å; I939-T943 WeakPolarHBondContact O-CG2 3.49Å; I939-T943 PolarHBondContact O-N 3Å; I939-T943 PolarHBondContact O-OG1 3.37Å
940	T	88	Confident	86	Confident	28 Å²	28	40.6 Å²	40.6	17%	0.172	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-38.6	177.1	-59.8	0	0	0	0	111.5	Y818 D936 Y937 T938 T943 R944	Y818-T940 HydrophobicContact CD2-CG2 4.29Å; Y818-T940 HydrophobicContact CE1-CG2 3.93Å; Y818-T940 HydrophobicContact CE2-CG2 3.67Å; D936-T940 VanDerWaalsContact O-CB 3.23Å; D936-T940 WeakPolarHBondContact O-CB 3.37Å; D936-T940 PolarHBondContact O-N 3.32Å; D936-T940 PolarHBondContact O-OG1 3.2Å; Y937-T940 PolarHBondContact O-N 3.29Å; T938-T940 PolarHBondContact O-N 3.11Å; T940-T943 PolarHBondContact O-OG1 3.3Å; T940-R944 WeakPolarHBondContact O-CB 3.42Å; T940-R944 PolarHBondContact O-N 2.87Å
941	F	90.3	Very high	86.2	Confident	0 Å²	0	45 Å²	45	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-54.4	174.4	-178.5	-82.5	0	0	0	111.3	F821 E822 I825 L826 L841 Y937 T938 I939 T943 R944 W945 Y946	F821-F941 HydrophobicContact CE1-CB 4.2Å; E822-F941 HydrophobicContact CG-CD2 4.31Å; I825-F941 HydrophobicContact CB-CD2 4.05Å; I825-F941 HydrophobicContact CB-CE2 3.76Å; I825-F941 HydrophobicContact CB-CZ 4.2Å; I825-F941 HydrophobicContact CG2-CD1 4.06Å; I825-F941 HydrophobicContact CG2-CD2 3.87Å; I825-F941 HydrophobicContact CG2-CE1 3.71Å; I825-F941 HydrophobicContact CG2-CE2 3.48Å; I825-F941 VanDerWaalsContact CG2-CE2 3.48Å; I825-F941 HydrophobicContact CG2-CG 4.15Å; I825-F941 HydrophobicContact CG2-CZ 3.42Å; I825-F941 VanDerWaalsContact CG2-CZ 3.42Å; L826-F941 HydrophobicContact CD2-CE2 3.89Å; L826-F941 HydrophobicContact CD2-CZ 3.94Å; L826-F941 HydrophobicContact CG-CE2 3.88Å; L826-F941 HydrophobicContact CG-CZ 4.41Å; L841-F941 HydrophobicContact CD1-CD1 4.34Å; L841-F941 HydrophobicContact CD2-CD1 3.75Å; L841-F941 HydrophobicContact CD2-CE1 4.16Å; Y937-F941 WeakPolarHBondContact O-CB 3.38Å; Y937-F941 PolarHBondContact O-N 3.26Å; T938-F941 PolarHBondContact O-N 2.82Å; I939-F941 VanDerWaalsContact C-N 3.35Å; F941-T943 PolarHBondContact O-N 3.4Å; F941-R944 PolarHBondContact O-N 3.41Å; F941-R944 VanDerWaalsContact O-N 3.1Å; F941-W945 AromaticContact CD2-CD1 3.78Å; F941-W945 HydrophobicContact CE1-CB 4.33Å; F941-W945 AromaticContact CE2-CD1 3.7Å; F941-W945 HydrophobicContact CE2-CG 4.46Å; F941-W945 HydrophobicContact CZ-CB 4.45Å; F941-W945 AromaticContact CZ-CD1 3.99Å; F941-W945 HydrophobicContact CZ-CG 4.35Å; F941-W945 PolarHBondContact O-N 3.2Å; F941-Y946 HydrophobicContact CE1-CD2 4.22Å; F941-Y946 HydrophobicContact CE1-CE1 4.28Å; F941-Y946 AromaticContact CE1-CE2 3.74Å; F941-Y946 HydrophobicContact CE1-CE2 3.74Å; F941-Y946 AromaticContact CE1-CZ 3.77Å
942	F	89.4	Confident	86.4	Confident	31 Å²	31	51 Å²	51	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-57.5	-47.7	-179.9	174.7	-93.1	0	0	0	111.7	I838 L841 T938 R944 Y946 A947 V950 W956	I838-F942 HydrophobicContact CD1-CE2 4.38Å; I838-F942 HydrophobicContact CG1-CE2 4.34Å; I838-F942 HydrophobicContact CG2-CD2 4.48Å; I838-F942 HydrophobicContact CG2-CE2 4.04Å; L841-F942 HydrophobicContact CD2-CB 4.25Å; T938-F942 WeakPolarHBondContact O-CB 3.4Å; T938-F942 PolarHBondContact O-N 2.89Å; F942-R944 PolarHBondContact O-N 2.96Å; F942-Y946 HydrophobicContact CD2-CD2 4.36Å; F942-Y946 PolarHBondContact O-N 3.26Å; F942-A947 HydrophobicContact CD1-CB 4.26Å; F942-A947 HydrophobicContact CE1-CB 3.93Å; F942-A947 PolarHBondContact O-N 2.71Å; F942-V950 HydrophobicContact CE2-CG2 3.99Å; F942-V950 HydrophobicContact CZ-CB 4.35Å; F942-V950 HydrophobicContact CZ-CG1 4.43Å; F942-V950 HydrophobicContact CZ-CG2 3.86Å; F942-W956 HydrophobicContact CD2-CH2 4.48Å; F942-W956 HydrophobicContact CE1-CH2 4.31Å; F942-W956 AromaticContact CE1-CZ2 3.74Å; F942-W956 HydrophobicContact CE1-CZ2 3.74Å; F942-W956 AromaticContact CE2-CH2 3.58Å; F942-W956 HydrophobicContact CE2-CH2 3.58Å; F942-W956 AromaticContact CE2-CZ2 3.87Å; F942-W956 HydrophobicContact CE2-CZ2 3.87Å; F942-W956 AromaticContact CZ-CH2 3.48Å; F942-W956 HydrophobicContact CZ-CH2 3.48Å; F942-W956 VanDerWaalsContact CZ-CH2 3.48Å; F942-W956 AromaticContact CZ-CZ2 3.26Å; F942-W956 HydrophobicContact CZ-CZ2 3.26Å; F942-W956 HydrophobicContact CZ-CZ3 4.49Å
943	T	87	Confident	86.4	Confident	58 Å²	58	55.7 Å²	55.7	36%	0.356	25%	0.248	S	C	.	.	H	α-helix	trans	-67.9	-19	179.8	54.9	0	0	0	0	114	I939 T940 F941	I939-T943 HydrophobicContact CG2-CG2 4.22Å; I939-T943 WeakPolarHBondContact O-CB 3.43Å; I939-T943 VanDerWaalsContact O-CG2 3.29Å; I939-T943 WeakPolarHBondContact O-CG2 3.49Å; I939-T943 PolarHBondContact O-N 3Å; I939-T943 PolarHBondContact O-OG1 3.37Å; T940-T943 PolarHBondContact O-OG1 3.3Å; F941-T943 PolarHBondContact O-N 3.4Å
944	R	87.8	Confident	85.8	Confident	152 Å²	152	55.7 Å²	55.7	57%	0.574	27%	0.265	S	S	*	.	H	α-helix	trans	-92.9	-37.7	179.1	176.6	171.4	161.4	107.2	-16.5	113.5	E822 T940 F941 F942	E822-R944 IonicContact OE1-CZ 2.67Å; E822-R944 IonicContact OE1-NE 3.25Å; E822-R944 PolarHBondContact OE1-NE 2.96Å; E822-R944 IonicContact OE1-NH2 3.43Å; E822-R944 PolarHBondContact OE1-NH2 3.14Å; E822-R944 IonicContact OE2-CZ 3.29Å; E822-R944 IonicContact OE2-NE 2.75Å; E822-R944 PolarHBondContact OE2-NE 2.83Å; E822-R944 IonicContact OE2-NH2 2.69Å; E822-R944 PolarHBondContact OE2-NH2 2.77Å; T940-R944 WeakPolarHBondContact O-CB 3.42Å; T940-R944 PolarHBondContact O-N 2.87Å; F941-R944 PolarHBondContact O-N 3.41Å; F941-R944 VanDerWaalsContact O-N 3.1Å; F942-R944 PolarHBondContact O-N 2.96Å
945	W	88.4	Confident	85.4	Confident	70 Å²	70	56.1 Å²	56.1	27%	0.265	27%	0.271	S	S	.	.	H	α-helix	trans	-107.1	-41.9	-173.3	-69.4	107.4	0	0	0	114	E822 L826 R831 F941	E822-W945 VanDerWaalsContact OE1-CZ2 3.31Å; E822-W945 WeakPolarHBondContact OE1-CZ2 3.38Å; E822-W945 PolarHBondContact OE1-NE1 3.29Å; L826-W945 HydrophobicContact CD1-CH2 4.23Å; L826-W945 HydrophobicContact CD1-CZ2 3.62Å; L826-W945 HydrophobicContact CD2-CD2 3.91Å; L826-W945 HydrophobicContact CD2-CE3 4.34Å; L826-W945 HydrophobicContact CD2-CG 4.24Å; L826-W945 HydrophobicContact CD2-CZ2 4.21Å; L826-W945 HydrophobicContact CG-CZ2 4.42Å; R831-W945 HydrophobicContact CB-CE3 4.48Å; R831-W945 HydrophobicContact CB-CZ3 4.32Å; R831-W945 HydrophobicContact CG-CE3 4.35Å; R831-W945 HydrophobicContact CG-CH2 4.31Å; R831-W945 HydrophobicContact CG-CZ3 3.94Å; F941-W945 AromaticContact CD2-CD1 3.78Å; F941-W945 HydrophobicContact CE1-CB 4.33Å; F941-W945 AromaticContact CE2-CD1 3.7Å; F941-W945 HydrophobicContact CE2-CG 4.46Å; F941-W945 HydrophobicContact CZ-CB 4.45Å; F941-W945 AromaticContact CZ-CD1 3.99Å; F941-W945 HydrophobicContact CZ-CG 4.35Å; F941-W945 PolarHBondContact O-N 3.2Å
946	Y	87.5	Confident	84.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-29	-166.7	-62.2	-14.2	0	0	0	113.8	L829 G830 P833 R837 I838 L841 F941 F942 D948 W949 V950	L829-Y946 WeakPolarHBondContact CB-OH 3.49Å; L829-Y946 HydrophobicContact CD1-CE2 4.5Å; G830-Y946 PolarHBondContact O-OH 2.87Å; P833-Y946 HydrophobicContact CB-CD1 3.53Å; P833-Y946 HydrophobicContact CB-CE1 4.05Å; P833-Y946 HydrophobicContact CB-CG 3.98Å; P833-Y946 HydrophobicContact CG-CD1 4.22Å; R837-Y946 HydrophobicContact CB-CE2 4.49Å; I838-Y946 HydrophobicContact CD1-CD2 4.5Å; I838-Y946 HydrophobicContact CG1-CD2 3.64Å; I838-Y946 HydrophobicContact CG1-CE2 4.25Å; I838-Y946 HydrophobicContact CG1-CG 4.26Å; L841-Y946 HydrophobicContact CD2-CD2 4.19Å; L841-Y946 HydrophobicContact CD2-CE2 4.2Å; F941-Y946 HydrophobicContact CE1-CD2 4.22Å; F941-Y946 HydrophobicContact CE1-CE1 4.28Å; F941-Y946 AromaticContact CE1-CE2 3.74Å; F941-Y946 HydrophobicContact CE1-CE2 3.74Å; F941-Y946 AromaticContact CE1-CZ 3.77Å; F942-Y946 HydrophobicContact CD2-CD2 4.36Å; F942-Y946 PolarHBondContact O-N 3.26Å; Y946-D948 VanDerWaalsContact C-N 3.29Å; Y946-D948 PolarHBondContact O-N 2.77Å; Y946-W949 WeakPolarHBondContact O-CA 3.49Å; Y946-W949 WeakPolarHBondContact O-CB 3.43Å; Y946-W949 PolarHBondContact O-N 2.87Å; Y946-V950 PolarHBondContact O-N 2.89Å
947	A	85.8	Confident	84	Confident	26 Å²	26	62.4 Å²	62.4	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-31.1	-177.9	0	0	0	0	0	114.3	F942 W949 Y951	F942-A947 HydrophobicContact CD1-CB 4.26Å; F942-A947 HydrophobicContact CE1-CB 3.93Å; F942-A947 PolarHBondContact O-N 2.71Å; A947-W949 PolarHBondContact O-N 3.26Å; A947-Y951 VanDerWaalsContact O-CB 3.24Å; A947-Y951 WeakPolarHBondContact O-CB 3.46Å; A947-Y951 PolarHBondContact O-N 2.99Å
948	D	83.7	Confident	82.7	Confident	72 Å²	72	60.9 Å²	60.9	39%	0.385	29%	0.289	S	S	.	.	H	α-helix	trans	-72	-8.4	175.1	-113.9	2.9	0	0	0	113.3	R393 Y946 K952	R393-D948 IonicContact CZ-OD1 3.27Å; R393-D948 IonicContact CZ-OD2 3Å; R393-D948 VanDerWaalsContact CZ-OD2 3.29Å; R393-D948 IonicContact NH1-OD1 2.98Å; R393-D948 PolarHBondContact NH1-OD1 2.86Å; R393-D948 IonicContact NH1-OD2 2.63Å; R393-D948 PolarHBondContact NH1-OD2 2.83Å; R393-D948 IonicContact NH2-OD2 3.92Å; R393-D948 PolarHBondContact NH2-OD2 2.81Å; Y946-D948 VanDerWaalsContact C-N 3.29Å; Y946-D948 PolarHBondContact O-N 2.77Å; D948-K952 VanDerWaalsContact O-CD 3.31Å; D948-K952 WeakPolarHBondContact O-CD 3.46Å; D948-K952 WeakPolarHBondContact O-CE 3.3Å; D948-K952 WeakPolarHBondContact O-CG 3.47Å
949	W	87.8	Confident	81.4	Confident	50 Å²	50	61.8 Å²	61.8	19%	0.189	29%	0.294	C	S	.	.	H	α-helix	trans	-103	-46.1	172.1	175.6	96.6	0	0	0	111.1	P833 W835 I838 Y946 A947 Y951 K952 R953	P833-W949 HydrophobicContact CB-CB 4.01Å; P833-W949 HydrophobicContact CB-CD2 3.73Å; P833-W949 HydrophobicContact CB-CE3 3.93Å; P833-W949 HydrophobicContact CB-CG 3.81Å; P833-W949 HydrophobicContact CG-CB 3.43Å; P833-W949 VanDerWaalsContact CG-CB 3.43Å; P833-W949 HydrophobicContact CG-CD2 3.79Å; P833-W949 HydrophobicContact CG-CE3 4.46Å; P833-W949 HydrophobicContact CG-CG 3.32Å; W835-W949 AromaticContact CD2-CH2 3.9Å; W835-W949 HydrophobicContact CD2-CH2 3.9Å; W835-W949 AromaticContact CD2-CZ3 3.75Å; W835-W949 HydrophobicContact CD2-CZ3 3.75Å; W835-W949 AromaticContact CE2-CH2 3.81Å; W835-W949 AromaticContact CE2-CZ3 3.75Å; W835-W949 HydrophobicContact CE3-CH2 4.45Å; W835-W949 AromaticContact CE3-CZ3 3.87Å; W835-W949 HydrophobicContact CE3-CZ3 3.87Å; W835-W949 HydrophobicContact CG-CH2 4.13Å; W835-W949 HydrophobicContact CG-CZ3 4.43Å; W835-W949 AromaticContact CH2-CZ3 3.99Å; W835-W949 HydrophobicContact CH2-CZ3 3.99Å; W835-W949 HydrophobicContact CZ2-CH2 4.26Å; W835-W949 AromaticContact CZ2-CZ3 3.85Å; W835-W949 HydrophobicContact CZ2-CZ3 3.85Å; W835-W949 AromaticContact CZ3-CZ3 3.99Å; W835-W949 HydrophobicContact CZ3-CZ3 3.99Å; W835-W949 AromaticContact NE1-CH2 3.99Å; I838-W949 HydrophobicContact CD1-CE3 4.07Å; I838-W949 HydrophobicContact CD1-CZ3 3.77Å; Y946-W949 WeakPolarHBondContact O-CA 3.49Å; Y946-W949 WeakPolarHBondContact O-CB 3.43Å; Y946-W949 PolarHBondContact O-N 2.87Å; A947-W949 PolarHBondContact O-N 3.26Å; W949-Y951 VanDerWaalsContact C-N 3.28Å; W949-Y951 PolarHBondContact O-N 3.4Å; W949-K952 WeakPolarHBondContact O-CA 3.29Å; W949-K952 WeakPolarHBondContact O-CB 3.43Å; W949-K952 PolarHBondContact O-N 3.49Å; W949-R953 PolarHBondContact O-N 2.89Å
950	V	83.9	Confident	79.9	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.042	30%	0.301	C	S	.	.	H	α-helix	trans	-52.9	-46.4	173.1	168.4	0	0	0	0	111	W835 I838 F942 Y946 K952 R953 G954 G955	W835-V950 HydrophobicContact CH2-CB 4.24Å; W835-V950 HydrophobicContact CH2-CG1 3.99Å; W835-V950 HydrophobicContact CH2-CG2 3.78Å; W835-V950 HydrophobicContact CZ3-CG1 4.4Å; W835-V950 HydrophobicContact CZ3-CG2 3.63Å; I838-V950 HydrophobicContact CD1-CG2 3.71Å; F942-V950 HydrophobicContact CE2-CG2 3.99Å; F942-V950 HydrophobicContact CZ-CB 4.35Å; F942-V950 HydrophobicContact CZ-CG1 4.43Å; F942-V950 HydrophobicContact CZ-CG2 3.86Å; Y946-V950 PolarHBondContact O-N 2.89Å; V950-K952 PolarHBondContact O-N 2.94Å; V950-K952 VanDerWaalsContact O-N 3.16Å; V950-R953 PolarHBondContact O-N 2.98Å; V950-G954 PolarHBondContact O-N 2.98Å; V950-G955 PolarHBondContact O-N 3.23Å; V950-G955 VanDerWaalsContact O-N 3.07Å
951	Y	83.1	Confident	78.4	Confident	125 Å²	125	67.7 Å²	67.7	49%	0.49	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-14	176.7	-174.3	-103	0	0	0	114.6	I354 A947 W949	I354-Y951 HydrophobicContact CD1-CE2 4.18Å; A947-Y951 VanDerWaalsContact O-CB 3.24Å; A947-Y951 WeakPolarHBondContact O-CB 3.46Å; A947-Y951 PolarHBondContact O-N 2.99Å; W949-Y951 VanDerWaalsContact C-N 3.28Å; W949-Y951 PolarHBondContact O-N 3.4Å
952	K	83.9	Confident	76.6	Confident	169 Å²	169	71.7 Å²	71.7	74%	0.735	34%	0.339	S	S	*	.	H	α-helix	trans	-88	-26.8	174.2	-68.3	171.7	-175.7	164.9	0	113.2	D948 W949 V950	D948-K952 VanDerWaalsContact O-CD 3.31Å; D948-K952 WeakPolarHBondContact O-CD 3.46Å; D948-K952 WeakPolarHBondContact O-CE 3.3Å; D948-K952 WeakPolarHBondContact O-CG 3.47Å; W949-K952 WeakPolarHBondContact O-CA 3.29Å; W949-K952 WeakPolarHBondContact O-CB 3.43Å; W949-K952 PolarHBondContact O-N 3.49Å; V950-K952 PolarHBondContact O-N 2.94Å; V950-K952 VanDerWaalsContact O-N 3.16Å
953	R	77.8	Confident	74.8	Confident	121 Å²	121	70.5 Å²	70.5	46%	0.457	33%	0.334	S	S	.	.	H	α-helix	trans	-83.8	-27.8	179.7	-73.9	-163.8	151.7	-170.2	-11.2	113.5	W949 V950 S958 E962	W949-R953 PolarHBondContact O-N 2.89Å; V950-R953 PolarHBondContact O-N 2.98Å; R953-S958 WeakPolarHBondContact CB-OG 3.4Å; R953-S958 WeakPolarHBondContact O-CB 3.2Å; R953-S958 PolarHBondContact O-OG 2.73Å; R953-E962 WeakPolarHBondContact CD-OE1 3.43Å; R953-E962 VanDerWaalsContact CD-OE2 3.24Å; R953-E962 WeakPolarHBondContact CD-OE2 3.33Å; R953-E962 IonicContact CZ-OE1 3.27Å; R953-E962 IonicContact CZ-OE2 3.14Å; R953-E962 VanDerWaalsContact CZ-OE2 3.26Å; R953-E962 IonicContact NE-OE1 2.7Å; R953-E962 PolarHBondContact NE-OE1 3.48Å; R953-E962 IonicContact NE-OE2 3.2Å; R953-E962 VanDerWaalsContact NH1-CD 3.32Å; R953-E962 IonicContact NH1-OE1 3.79Å; R953-E962 PolarHBondContact NH1-OE1 3.47Å; R953-E962 IonicContact NH1-OE2 3.01Å; R953-E962 PolarHBondContact NH1-OE2 3.42Å; R953-E962 IonicContact NH2-OE1 3Å
954	G	74.1	Confident	72.8	Confident	55 Å²	55	74.9 Å²	74.9	57%	0.567	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	152	-24.1	178	0	0	0	0	0	112.3	V950 S958	V950-G954 PolarHBondContact O-N 2.98Å; G954-S958 PolarHBondContact N-OG 2.8Å
955	G	78.4	Confident	70.6	Confident	14 Å²	14	76 Å²	76	14%	0.144	37%	0.368	C	S	.	.	S	Bend	trans	121	-143.3	-174.4	0	0	0	0	0	108.7	W835 V950 Q957 S958	W835-G955 WeakPolarHBondContact CH2-O 3.24Å; V950-G955 PolarHBondContact O-N 3.23Å; V950-G955 VanDerWaalsContact O-N 3.07Å; G955-Q957 VanDerWaalsContact C-N 3.34Å; G955-S958 PolarHBondContact N-OG 3.02Å; G955-S958 PolarHBondContact O-OG 3.39Å; G955-S958 VanDerWaalsContact O-OG 3.05Å
956	W	75	Confident	68.2	Low	134 Å²	134	75.1 Å²	75.1	51%	0.508	37%	0.373	S	S	.	.	S	Bend	trans	-78.8	-18	172.3	-63.3	110.9	0	0	0	113.1	W835 I838 F942 S958 V959	W835-W956 HydrophobicContact CZ3-CE3 4.28Å; W835-W956 HydrophobicContact CZ3-CZ3 4.25Å; I838-W956 HydrophobicContact CG2-CH2 3.92Å; I838-W956 HydrophobicContact CG2-CZ3 3.83Å; F942-W956 HydrophobicContact CD2-CH2 4.48Å; F942-W956 HydrophobicContact CE1-CH2 4.31Å; F942-W956 AromaticContact CE1-CZ2 3.74Å; F942-W956 HydrophobicContact CE1-CZ2 3.74Å; F942-W956 AromaticContact CE2-CH2 3.58Å; F942-W956 HydrophobicContact CE2-CH2 3.58Å; F942-W956 AromaticContact CE2-CZ2 3.87Å; F942-W956 HydrophobicContact CE2-CZ2 3.87Å; F942-W956 AromaticContact CZ-CH2 3.48Å; F942-W956 HydrophobicContact CZ-CH2 3.48Å; F942-W956 VanDerWaalsContact CZ-CH2 3.48Å; F942-W956 AromaticContact CZ-CZ2 3.26Å; F942-W956 HydrophobicContact CZ-CZ2 3.26Å; F942-W956 HydrophobicContact CZ-CZ3 4.49Å; W956-S958 VanDerWaalsContact C-N 3.32Å; W956-S958 PolarHBondContact O-N 3.44Å; W956-V959 HydrophobicContact CE3-CG2 3.85Å; W956-V959 HydrophobicContact CZ3-CG2 4.47Å; W956-V959 WeakPolarHBondContact O-CB 3.24Å; W956-V959 WeakPolarHBondContact O-CG2 3.38Å; W956-V959 PolarHBondContact O-N 3.46Å
957	Q	66.6	Low	65.8	Low	93 Å²	93	83 Å²	83	44%	0.435	41%	0.41	S	S	.	.	H	α-helix	trans	-60.4	-44	176.1	-165.5	67.8	33.4	0	0	111.5	G955 V959 I960 E961	G955-Q957 VanDerWaalsContact C-N 3.34Å; Q957-V959 PolarHBondContact O-N 3.39Å; Q957-V959 VanDerWaalsContact O-N 3.08Å; Q957-I960 WeakPolarHBondContact O-CB 3.25Å; Q957-I960 PolarHBondContact O-N 3.5Å; Q957-I960 VanDerWaalsContact O-N 3.09Å; Q957-E961 HydrophobicContact CG-CG 4.42Å; Q957-E961 VanDerWaalsContact CG-OE1 3.25Å; Q957-E961 WeakPolarHBondContact CG-OE1 3.48Å; Q957-E961 PolarHBondContact O-N 3.03Å
958	S	63.8	Low	63.4	Low	2 Å²	2	84.4 Å²	84.4	1%	0.014	41%	0.413	C	S	.	.	H	α-helix	trans	-75.2	15.2	174.6	60.5	0	0	0	0	114.1	W835 R953 G954 G955 W956	W835-S958 VanDerWaalsContact CE2-O 3.28Å; W835-S958 WeakPolarHBondContact CZ2-O 3.2Å; W835-S958 PolarHBondContact NE1-O 3.34Å; R953-S958 WeakPolarHBondContact CB-OG 3.4Å; R953-S958 WeakPolarHBondContact O-CB 3.2Å; R953-S958 PolarHBondContact O-OG 2.73Å; G954-S958 PolarHBondContact N-OG 2.8Å; G955-S958 PolarHBondContact N-OG 3.02Å; G955-S958 PolarHBondContact O-OG 3.39Å; G955-S958 VanDerWaalsContact O-OG 3.05Å; W956-S958 VanDerWaalsContact C-N 3.32Å; W956-S958 PolarHBondContact O-N 3.44Å
959	V	59.4	Low	61	Low	36 Å²	36	90.8 Å²	90.8	22%	0.218	45%	0.447	C	S	.	.	H	α-helix	trans	-76.4	-65.7	153.7	178.4	0	0	0	0	106.3	W835 W956 Q957 E961 E962 T963	W835-V959 HydrophobicContact CD2-CG2 3.95Å; W835-V959 HydrophobicContact CE3-CG2 3.61Å; W835-V959 HydrophobicContact CH2-CG2 3.54Å; W835-V959 HydrophobicContact CZ2-CG2 3.89Å; W835-V959 HydrophobicContact CZ3-CG2 3.39Å; W956-V959 HydrophobicContact CE3-CG2 3.85Å; W956-V959 HydrophobicContact CZ3-CG2 4.47Å; W956-V959 WeakPolarHBondContact O-CB 3.24Å; W956-V959 WeakPolarHBondContact O-CG2 3.38Å; W956-V959 PolarHBondContact O-N 3.46Å; Q957-V959 PolarHBondContact O-N 3.39Å; Q957-V959 VanDerWaalsContact O-N 3.08Å; V959-E961 VanDerWaalsContact C-N 3.34Å; V959-E961 PolarHBondContact O-N 2.64Å; V959-E962 CarbonylContact O-C 3.57Å; V959-E962 WeakPolarHBondContact O-CA 3.3Å; V959-E962 PolarHBondContact O-N 3.24Å; V959-T963 HydrophobicContact CG1-CG2 3.92Å; V959-T963 WeakPolarHBondContact O-CG2 3.43Å; V959-T963 PolarHBondContact O-N 3.22Å; V959-T963 PolarHBondContact O-OG1 3.48Å
960	I	57.4	Low	59.7	Low	82 Å²	82	92.9 Å²	92.9	42%	0.421	46%	0.46	S	S	.	.	H	α-helix	trans	-47.5	-55.6	-177.9	-49.5	171	0	0	0	110.4	Q957 E962 T963 E964	Q957-I960 WeakPolarHBondContact O-CB 3.25Å; Q957-I960 PolarHBondContact O-N 3.5Å; Q957-I960 VanDerWaalsContact O-N 3.09Å; I960-E962 PolarHBondContact O-N 3.44Å; I960-T963 PolarHBondContact O-N 3.36Å; I960-T963 VanDerWaalsContact O-N 3.11Å; I960-E964 HydrophobicContact CG2-CG 4.37Å; I960-E964 WeakPolarHBondContact CG2-OE1 3.49Å; I960-E964 WeakPolarHBondContact O-CG 3.31Å; I960-E964 PolarHBondContact O-N 3.22Å; I960-E964 VanDerWaalsContact O-N 3.12Å
961	E	56	Low	58.4	Low	124 Å²	124	97.4 Å²	97.4	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-63	-13.6	180	-54.6	164.1	166.4	0	0	114.8	Q957 V959	Q957-E961 HydrophobicContact CG-CG 4.42Å; Q957-E961 VanDerWaalsContact CG-OE1 3.25Å; Q957-E961 WeakPolarHBondContact CG-OE1 3.48Å; Q957-E961 PolarHBondContact O-N 3.03Å; V959-E961 VanDerWaalsContact C-N 3.34Å; V959-E961 PolarHBondContact O-N 2.64Å
962	E	52.2	Low	57	Low	85 Å²	85	95.8 Å²	95.8	40%	0.397	48%	0.482	S	S	.	.	H	α-helix	trans	-118	-1.9	176.7	-67.1	-171.5	151.5	0	0	113.5	W835 R953 V959 I960	W835-E962 PolarHBondContact NE1-OE2 2.96Å; R953-E962 WeakPolarHBondContact CD-OE1 3.43Å; R953-E962 VanDerWaalsContact CD-OE2 3.24Å; R953-E962 WeakPolarHBondContact CD-OE2 3.33Å; R953-E962 IonicContact CZ-OE1 3.27Å; R953-E962 IonicContact CZ-OE2 3.14Å; R953-E962 VanDerWaalsContact CZ-OE2 3.26Å; R953-E962 IonicContact NE-OE1 2.7Å; R953-E962 PolarHBondContact NE-OE1 3.48Å; R953-E962 IonicContact NE-OE2 3.2Å; R953-E962 VanDerWaalsContact NH1-CD 3.32Å; R953-E962 IonicContact NH1-OE1 3.79Å; R953-E962 PolarHBondContact NH1-OE1 3.47Å; R953-E962 IonicContact NH1-OE2 3.01Å; R953-E962 PolarHBondContact NH1-OE2 3.42Å; R953-E962 IonicContact NH2-OE1 3Å; V959-E962 CarbonylContact O-C 3.57Å; V959-E962 WeakPolarHBondContact O-CA 3.3Å; V959-E962 PolarHBondContact O-N 3.24Å; I960-E962 PolarHBondContact O-N 3.44Å
963	T	50.8	Low	55.4	Low	5 Å²	5	91.5 Å²	91.5	3%	0.031	47%	0.467	C	S	.	.	H	α-helix	trans	-118.7	-10.4	-179	60	0	0	0	0	114.9	V959 I960 D965 S966 L968	V959-T963 HydrophobicContact CG1-CG2 3.92Å; V959-T963 WeakPolarHBondContact O-CG2 3.43Å; V959-T963 PolarHBondContact O-N 3.22Å; V959-T963 PolarHBondContact O-OG1 3.48Å; I960-T963 PolarHBondContact O-N 3.36Å; I960-T963 VanDerWaalsContact O-N 3.11Å; T963-D965 PolarHBondContact O-N 2.61Å; T963-S966 WeakPolarHBondContact CA-OG 3.42Å; T963-S966 PolarHBondContact O-N 3.3Å; T963-S966 PolarHBondContact O-OG 3.42Å; T963-L968 HydrophobicContact CG2-CB 4.45Å
964	E	45.4	Very low	54	Low	151 Å²	151	89.7 Å²	89.7	71%	0.706	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-23.5	174.8	-84.5	171	-164.2	0	0	114.3	I960	I960-E964 HydrophobicContact CG2-CG 4.37Å; I960-E964 WeakPolarHBondContact CG2-OE1 3.49Å; I960-E964 WeakPolarHBondContact O-CG 3.31Å; I960-E964 PolarHBondContact O-N 3.22Å; I960-E964 VanDerWaalsContact O-N 3.12Å
965	D	42.2	Very low	52.7	Low	175 Å²	175	92 Å²	92	94%	0.936	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	13.1	175.6	-80.8	-37.7	0	0	0	114.5	T963	T963-D965 PolarHBondContact O-N 2.61Å
966	S	37.3	Very low	50.9	Low	52 Å²	52	97.6 Å²	97.6	36%	0.364	48%	0.484	S	S	.	.	S	Bend	trans	-139.5	149.8	-169.4	69.7	0	0	0	0	115.5	T963 L968	T963-S966 WeakPolarHBondContact CA-OG 3.42Å; T963-S966 PolarHBondContact O-N 3.3Å; T963-S966 PolarHBondContact O-OG 3.42Å; S966-L968 PolarHBondContact O-N 3.24Å
967	E	36.2	Very low	49	Very low	166 Å²	166	94.8 Å²	94.8	78%	0.776	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	56.1	175.9	-59.3	176.6	100	0	0	112.9	N800	N800-E967 PolarHBondContact ND2-OE1 2.98Å
968	L	37.3	Very low	47.5	Very low	55 Å²	55	94.9 Å²	94.9	29%	0.288	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.6	7.3	-169.3	-105.9	166.1	0	0	0	115.7	H836 A839 T963 S966	H836-L968 HydrophobicContact CB-CD1 4.07Å; A839-L968 HydrophobicContact CB-CD2 3.55Å; T963-L968 HydrophobicContact CG2-CB 4.45Å; S966-L968 PolarHBondContact O-N 3.24Å
969	D	32.5	Very low	46.1	Very low	206 Å²	206	103.4 Å²	103.4	100%	1.102	53%	0.529	S	S	*	.			trans	-69.4	0	156.5	-75.9	-14.6	0	0	0	110.9

Retrieved 969 of 969 residues in 257.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).