A0A096MPJ2_PAPAN Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A096MPJ2, Species PAPAN (Papio anubis, Olive baboon), Gene HIPK1, Length 1,210 aa.

						>A0A096MPJ2_PAPAN|A0A096MPJ2|HIPK1
MASQLQVFSPPSVSSSAFCSAKKLKIEPSGWDVSGQSSNDKYYTHSKTLPATQGQANSSHQVANFSIPAYDQGLLLPAPAVEHIVVTAADSSGSAATSTFQSSQSLTHRSNVSLLEPYQKCGLKRKSEEVDSNGSVQIIEEHPPLMLQNRTVVGAAATTTTVTTKSSSSSGEGDYQLVQHEILCSMTNSYEVLEFLGRGTFGQVAKCWKRSTKEIVAIKILKNHPSYARQGQIEVSILSRLSSENADEYNFVRSYECFQHKNHTCLVFEMLEQNLYDFLKQNKFSPLPLKYIRPILQQVATALMKLKSLGLIHADLKPENIMLVDPVRQPYRVKVIDFGSASHVSKAVCSTYLQSRYYRAPEIILGLPFCEAIDMWSLGCVIAELFLGWPLYPGASEYDQIRYISQTQGLPAEYLLSAGTKTTRFFNRDPNLGYPLWRLKTPEEHELETGIKSKEARKYIFNCLDDMAQVNMSTDLEGTDMLAEKADRREYIDLLKKMLTIDADKRITPLKTLNHQFVTMTHLLDFPHSNHVKSCFQNMEICKRRVHMYDTVSQIKSPFTTHVAPNTSTNLTMSFSNQLNTVHNQASVLASSSTAAAATLSLANSDVSLLNYQSALYPSSAAPVPGVAQQGVSLQPGTTQICTQTDPFQQTFIVCPPAFQTGLQATAKHSGFPVRMDNAVPIVPQAPAAQPLQIQSGVLTQGSCTPLMVATLHPQVATITPQYAVPFTLSCAAGRPALVEQTAAVLQAWPGGTQQILLPSTWQQLPGVALHNSVQPTAMIPEAMGSGQQLADWRNAHSHGNQYSTIMQQPSLLTNHVTLATAQPLNVGVAHVVRQQQSSSLPSKKNKQSAPVSSKSSLDVLPSQVYSLVGSSPLRTTSSYNSLVPVQDQHQPIIIPDTPSPPVSVITIRSDTDEEEDNKYKPSSSSLKPRSNVISYVTVNDSPDSDSSLSSPYSTDTLSALRGNSGPVLEGPGRVVADGTGTRTIIVPPLKTQLGDCTVATQASGLLSNKTKPVASVSGQSSGCCITPTGYRAQRGGTGAAQPLNLSQNQQSSAAPASQERSSNPAPRRQQAFVAPLSQAPYTFQHGSPLHSTGHPHLAPAPAHLPSQAHLYTYAAPTSAAALGSTSSIAHLFSPQGSSRHAAAYTTHPSTLVHQVPVSVGPSLLTSASVAPAQYQHQFATQSYIGSSRGSTIYTGYPLSPTKISQYSYL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	28.1	Very low	243 Å²	243	150.4 Å²	150.4	100%	1.197	85%	0.845	S	S	*	*				0	159.9	0	-79	-164.3	-83.1	0	0	108.9
2	A	30.3	Very low	27.9	Very low	111 Å²	111	146.3 Å²	146.3	92%	0.917	83%	0.834	S	S	*	*			trans	62.9	127.8	-175.7	0	0	0	0	0	115.1
3	S	27.2	Very low	27.9	Very low	102 Å²	102	145.6 Å²	145.6	71%	0.713	83%	0.834	S	S	*	*			trans	-110.6	147.9	175.9	172.7	0	0	0	0	109.3
4	Q	30.7	Very low	27.5	Very low	195 Å²	195	142.4 Å²	142.4	91%	0.911	82%	0.824	S	S	*	*			trans	-129.9	116.3	158	-75.1	-167.1	-15	0	0	109.6
5	L	26	Very low	27.3	Very low	148 Å²	148	140.9 Å²	140.9	78%	0.775	83%	0.825	S	S	*	*			trans	-79.5	130.3	172.6	-77.9	146	0	0	0	109.6	V7	L5-V7 HydrophobicContact CB-CG2 4.27Å
6	Q	29.9	Very low	27.3	Very low	190 Å²	190	138.7 Å²	138.7	89%	0.888	82%	0.82	S	S	*	*			trans	-75.1	127.4	157.5	-74.7	-177.1	-34.6	0	0	108.8
7	V	24.9	Very low	27.3	Very low	114 Å²	114	135.4 Å²	135.4	69%	0.691	81%	0.812	S	S	*	*			trans	-130	117.1	173	177.8	0	0	0	0	108.3	L5	L5-V7 HydrophobicContact CB-CG2 4.27Å
8	F	27.5	Very low	27.1	Very low	202 Å²	202	139.6 Å²	139.6	89%	0.886	82%	0.818	S	S	*	*			trans	-79.2	138.4	163.9	-88.4	-94.3	0	0	0	109.4
9	S	25.8	Very low	27.1	Very low	104 Å²	104	138.6 Å²	138.6	73%	0.727	82%	0.818	S	S	*	*			trans	-154.7	150.9	165.6	-79.3	0	0	0	0	110
10	P	28.7	Very low	27	Very low	111 Å²	111	137.8 Å²	137.8	72%	0.721	82%	0.82	S	S	*	*			trans	-97.1	155.8	-156.4	36.7	-36.5	0	0	0	114.6	S12	P10-S12 PolarHBondContact O-N 3.35Å
11	P	27	Very low	27.1	Very low	134 Å²	134	135.6 Å²	135.6	87%	0.87	82%	0.817	S	S	*	*			trans	-82.2	95.9	162.1	33.4	-30.5	0	0	0	110.4
12	S	25.5	Very low	26.8	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	80%	0.803	S	S	*	*			trans	-75.2	147.4	149.5	55	0	0	0	0	109.3	P10	P10-S12 PolarHBondContact O-N 3.35Å
13	V	27.4	Very low	26.7	Very low	137 Å²	137	137.7 Å²	137.7	83%	0.83	80%	0.799	S	S	*	*			trans	171.7	145.4	134.2	150.9	0	0	0	0	110.8
14	S	23.1	Very low	26.7	Very low	100 Å²	100	141 Å²	141	70%	0.699	81%	0.807	S	S	*	*			trans	-29.7	142.9	175.3	-43.2	0	0	0	0	118.7
15	S	24.8	Very low	26.4	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	79%	0.793	S	S	*	*			trans	-92.8	104.6	155.6	-173.2	0	0	0	0	109.8
16	S	27.4	Very low	26.6	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	80%	0.797	S	S	*	*			trans	-112.1	82	171.8	60.7	0	0	0	0	110	F18	S16-F18 PolarHBondContact O-N 2.82Å
17	A	26.2	Very low	26.4	Very low	83 Å²	83	136.7 Å²	136.7	69%	0.686	79%	0.785	S	S	*	*			trans	-90.5	93.5	-177.4	0	0	0	0	0	112	C19	A17-C19 PolarHBondContact O-N 2.79Å
18	F	24.2	Very low	26.7	Very low	211 Å²	211	137.1 Å²	137.1	93%	0.925	79%	0.79	S	S	*	*			trans	-67.5	118	161.5	-99	-99.2	0	0	0	109.5	S16	S16-F18 PolarHBondContact O-N 2.82Å
19	C	26.8	Very low	26.6	Very low	121 Å²	121	133.5 Å²	133.5	82%	0.818	79%	0.79	S	S	*	*			trans	-106.7	122.5	166.3	-74.6	0	0	0	0	110.2	A17 A21	A17-C19 PolarHBondContact O-N 2.79Å; C19-A21 PolarHBondContact O-N 3.5Å
20	S	25.3	Very low	26.6	Very low	121 Å²	121	131.7 Å²	131.7	85%	0.846	79%	0.788	S	S	*	*			trans	-75.7	121.4	-175.9	-176.1	0	0	0	0	111.9	K22	S20-K22 PolarHBondContact O-N 3.02Å
21	A	28.2	Very low	26.5	Very low	92 Å²	92	138.7 Å²	138.7	76%	0.76	80%	0.8	S	S	*	*			trans	-75.9	111	173.2	0	0	0	0	0	110.7	C19 K23	C19-A21 PolarHBondContact O-N 3.5Å; A21-K23 PolarHBondContact O-N 3.12Å
22	K	26.7	Very low	26.4	Very low	207 Å²	207	139.6 Å²	139.6	90%	0.9	80%	0.797	S	S	*	*			trans	-69.1	92.1	168.3	-87.7	-171.8	173.9	-179.5	0	110.2	S20 L24	S20-K22 PolarHBondContact O-N 3.02Å; K22-L24 PolarHBondContact O-N 2.66Å; K22-L24 VanDerWaalsContact O-N 3.13Å
23	K	27.5	Very low	26.5	Very low	192 Å²	192	141 Å²	141	84%	0.835	80%	0.801	S	S	*	*			trans	-66.1	102.8	173.3	-175.2	175.7	-176.8	175.2	0	110.5	A21 K25	A21-K23 PolarHBondContact O-N 3.12Å; K23-K25 PolarHBondContact O-N 3.43Å
24	L	27	Very low	26.5	Very low	170 Å²	170	139.9 Å²	139.9	89%	0.89	80%	0.799	S	S	*	*			trans	-67.6	124.1	163.8	-101.5	166.5	0	0	0	108.8	K22	K22-L24 PolarHBondContact O-N 2.66Å; K22-L24 VanDerWaalsContact O-N 3.13Å
25	K	23.8	Very low	26.6	Very low	141 Å²	141	138.4 Å²	138.4	61%	0.613	80%	0.8	S	S	*	*			trans	-102.4	107.2	180	-173.1	-167.9	-175.6	-157.4	0	108.9	K23 E27	K23-K25 PolarHBondContact O-N 3.43Å; K25-E27 WeakPolarHBondContact CE-OE1 3.38Å; K25-E27 WeakPolarHBondContact CE-OE2 3.39Å; K25-E27 IonicContact NZ-OE1 2.66Å; K25-E27 PolarHBondContact NZ-OE1 2.9Å; K25-E27 IonicContact NZ-OE2 2.74Å; K25-E27 PolarHBondContact NZ-OE2 3.41Å
26	I	31	Very low	26.7	Very low	166 Å²	166	142 Å²	142	85%	0.851	80%	0.804	S	S	*	*			trans	-89.5	135.7	158.5	-62.1	173.9	0	0	0	106.4
27	E	26	Very low	26.6	Very low	137 Å²	137	142.7 Å²	142.7	64%	0.64	81%	0.808	S	S	*	*			trans	-121.4	156.8	170.7	-115.5	176.9	-174.5	0	0	109.9	K25	K25-E27 WeakPolarHBondContact CE-OE1 3.38Å; K25-E27 WeakPolarHBondContact CE-OE2 3.39Å; K25-E27 IonicContact NZ-OE1 2.66Å; K25-E27 PolarHBondContact NZ-OE1 2.9Å; K25-E27 IonicContact NZ-OE2 2.74Å; K25-E27 PolarHBondContact NZ-OE2 3.41Å
28	P	31.5	Very low	26.7	Very low	123 Å²	123	143.6 Å²	143.6	80%	0.799	81%	0.81	S	S	*	*			trans	-92.9	158.4	-161.1	36.9	-35.8	0	0	0	113.5
29	S	25	Very low	26.8	Very low	126 Å²	126	141.1 Å²	141.1	88%	0.881	81%	0.806	S	S	*	*			trans	-129.1	115.4	156.3	49.4	0	0	0	0	108.9
30	G	26	Very low	26.8	Very low	66 Å²	66	140.5 Å²	140.5	68%	0.68	80%	0.795	S	S	*	*			trans	-142.6	118.2	175.6	0	0	0	0	0	109.8
31	W	26	Very low	27.1	Very low	258 Å²	258	141.3 Å²	141.3	98%	0.977	78%	0.783	S	S	*	*			trans	-147.3	111	172	-89.2	81.4	0	0	0	107.8
32	D	25.2	Very low	27	Very low	153 Å²	153	147.3 Å²	147.3	82%	0.818	79%	0.787	S	S	*	*			trans	-82.9	160.6	161.8	-84	-58.2	0	0	0	110.4
33	V	28.1	Very low	27	Very low	132 Å²	132	147.4 Å²	147.4	80%	0.8	78%	0.784	S	S	*	*			trans	159.3	132	133.4	155.2	0	0	0	0	112.2
34	S	26.1	Very low	27	Very low	112 Å²	112	143 Å²	143	78%	0.783	77%	0.772	S	S	*	*			trans	36	131.9	161.8	67.3	0	0	0	0	120.6
35	G	26.4	Very low	27	Very low	69 Å²	69	143.1 Å²	143.1	71%	0.711	77%	0.768	S	S	*	*			cis	102.7	112.9	40.2	0	0	0	0	0	112.8
36	Q	26.4	Very low	27.1	Very low	197 Å²	197	141.6 Å²	141.6	92%	0.921	78%	0.776	S	S	*	*			trans	64	117.9	158.4	-64.6	-174.6	-14.6	0	0	122.6
37	S	24.4	Very low	27	Very low	119 Å²	119	143 Å²	143	83%	0.832	78%	0.775	S	S	*	*			trans	171	166.7	131.1	41.3	0	0	0	0	111
38	S	28.2	Very low	27.1	Very low	103 Å²	103	142.9 Å²	142.9	72%	0.72	79%	0.785	S	S	*	*				-174	118.7	-69.3	47.8	0	0	0	0	111.4
39	N	27.9	Very low	26.8	Very low	158 Å²	158	144.7 Å²	144.7	85%	0.845	79%	0.787	S	S	*	*			trans	61.3	161.5	172.7	-65.9	-16.2	0	0	0	115.8
40	D	26.9	Very low	27.5	Very low	109 Å²	109	144.2 Å²	144.2	58%	0.583	78%	0.781	S	S	*	*			cis	-162	160.8	34.3	-144.4	-0.9	0	0	0	114.1
41	K	30.5	Very low	27.5	Very low	138 Å²	138	144.9 Å²	144.9	60%	0.6	78%	0.78	S	S	*	*			trans	21.1	145.9	157.8	-60.6	146.3	-165.6	148.2	0	121.7
42	Y	26.3	Very low	27.6	Very low	218 Å²	218	138.4 Å²	138.4	86%	0.855	77%	0.769	S	S	*	*				-165.8	166.7	60.8	-97.3	-77.3	0	0	0	115.6
43	Y	26.4	Very low	27.7	Very low	209 Å²	209	139.7 Å²	139.7	82%	0.82	77%	0.77	S	S	*	*			trans	-73.4	179	166.2	-84.7	-90.8	0	0	0	112.2
44	T	27.1	Very low	27.7	Very low	98 Å²	98	136.2 Å²	136.2	60%	0.601	76%	0.76	S	S	*	*			cis	-166.6	169.5	23.1	-19.3	0	0	0	0	112.2
45	H	27.5	Very low	27.7	Very low	173 Å²	173	140.3 Å²	140.3	80%	0.801	77%	0.767	S	S	*	*			trans	71.1	153.3	150.8	-71.2	-42	0	0	0	119.8
46	S	26.4	Very low	27.8	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	76%	0.763	S	S	*	*			cis	-156.2	170.5	-3.9	36.1	0	0	0	0	114.1
47	K	29.6	Very low	27.9	Very low	194 Å²	194	138.5 Å²	138.5	84%	0.843	76%	0.758	S	S	*	*			trans	-52.9	162.7	170.7	-54.7	170.9	-179.8	175	0	112.3
48	T	27	Very low	28	Very low	136 Å²	136	138.8 Å²	138.8	83%	0.834	76%	0.76	S	S	*	*				-166.8	158.5	60.2	42.7	0	0	0	0	116.2
49	L	26.2	Very low	28	Very low	161 Å²	161	139 Å²	139	84%	0.843	76%	0.761	S	S	*	*			trans	-72.6	169.9	158.4	-89.8	163.8	0	0	0	111.3
50	P	39.1	Very low	28.1	Very low	116 Å²	116	140.3 Å²	140.3	75%	0.753	76%	0.762	S	S	*	*			cis	-154.7	178.3	40.8	45.1	-23.7	0	0	0	120.9
51	A	26.3	Very low	28.1	Very low	80 Å²	80	144.6 Å²	144.6	66%	0.661	78%	0.779	S	S	*	*			trans	69.8	118.9	142.1	0	0	0	0	0	123.6
52	T	28.3	Very low	27.9	Very low	122 Å²	122	144.8 Å²	144.8	75%	0.748	79%	0.791	S	S	*	*			trans	29	135.7	135.5	57	0	0	0	0	121
53	Q	27.7	Very low	28	Very low	180 Å²	180	138.5 Å²	138.5	84%	0.841	79%	0.785	S	S	*	*			cis	-171	173.1	-3.2	-121.6	-176.5	-105.9	0	0	107.8
54	G	27.1	Very low	27.9	Very low	58 Å²	58	136.1 Å²	136.1	60%	0.598	79%	0.786	S	S	*	*			cis	116.4	104.9	-4.5	0	0	0	0	0	114.6
55	Q	27.2	Very low	27.9	Very low	198 Å²	198	140.7 Å²	140.7	93%	0.925	80%	0.798	S	S	*	*			trans	-149.4	147.9	179.1	-152	-176	22.2	0	0	113.3
56	A	28.3	Very low	27.7	Very low	77 Å²	77	137.6 Å²	137.6	64%	0.636	80%	0.796	S	S	*	*			trans	61.4	106.1	156.3	0	0	0	0	0	123.2
57	N	27	Very low	27.7	Very low	151 Å²	151	140.1 Å²	140.1	81%	0.807	80%	0.799	S	S	*	*				89.1	131.7	121.8	-69.6	4.3	0	0	0	125
58	S	28	Very low	28	Very low	126 Å²	126	136.1 Å²	136.1	88%	0.881	79%	0.792	S	S	*	*			trans	73.2	133.8	149.8	63.5	0	0	0	0	119.5
59	S	27.7	Very low	28.1	Very low	106 Å²	106	134 Å²	134	74%	0.741	79%	0.789	S	S	*	*			trans	-146.3	142.6	-171.7	57.4	0	0	0	0	110.8
60	H	29.9	Very low	28.2	Very low	186 Å²	186	135.5 Å²	135.5	86%	0.861	79%	0.785	S	S	*	*			trans	-155	111.3	151.3	-99.1	-66.3	0	0	0	111.5
61	Q	27.1	Very low	27.7	Very low	199 Å²	199	135.6 Å²	135.6	93%	0.93	78%	0.779	S	S	*	*			trans	-142.2	155.8	153.3	-77.4	-165.4	-13.2	0	0	107.8
62	V	26.3	Very low	27.8	Very low	142 Å²	142	140 Å²	140	86%	0.861	79%	0.786	S	S	*	*			trans	-129.5	131.8	-178.2	175.6	0	0	0	0	109.2
63	A	27.1	Very low	27.7	Very low	87 Å²	87	137.6 Å²	137.6	72%	0.719	79%	0.785	S	S	*	*			trans	-154.5	142.3	169.9	0	0	0	0	0	112.4
64	N	24	Very low	27.7	Very low	159 Å²	159	137 Å²	137	85%	0.85	79%	0.787	S	S	*	*			trans	68.5	161.5	158.3	-74.9	-10.7	0	0	0	122
65	F	27.8	Very low	27.7	Very low	194 Å²	194	142.1 Å²	142.1	85%	0.851	80%	0.8	S	S	*	*			trans	-76.5	153.7	-175.4	-63.5	-115.7	0	0	0	113.3
66	S	24.1	Very low	27.6	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	80%	0.797	S	S	*	*				166.1	107.8	128	-77.8	0	0	0	0	117.8
67	I	26.7	Very low	27.7	Very low	163 Å²	163	142.7 Å²	142.7	84%	0.836	80%	0.804	S	S	*	*			trans	49.8	-151.4	142	8	178.9	0	0	0	120.4
68	P	35.1	Very low	27.7	Very low	109 Å²	109	139.6 Å²	139.6	71%	0.708	80%	0.799	S	S	*	*				-125	157.7	-84.4	37.2	-23.1	0	0	0	119.8
69	A	29.1	Very low	27.8	Very low	92 Å²	92	139.9 Å²	139.9	76%	0.76	80%	0.798	S	S	*	*			trans	47.6	149.7	137.6	0	0	0	0	0	126.3
70	Y	28.1	Very low	27.8	Very low	193 Å²	193	139.1 Å²	139.1	76%	0.757	80%	0.798	S	S	*	*			trans	165.5	126.9	136.9	-106.5	-109.8	0	0	0	108.5
71	D	28.4	Very low	27.6	Very low	117 Å²	117	136.1 Å²	136.1	63%	0.626	79%	0.793	S	S	*	*				74.8	140.5	65.8	-146.8	32.6	0	0	0	113.2
72	Q	29.2	Very low	27.9	Very low	173 Å²	173	134.9 Å²	134.9	81%	0.808	79%	0.787	S	S	*	*			cis	-162.2	156.7	26	-168.8	171.8	94.4	0	0	114.9
73	G	26.6	Very low	27.8	Very low	72 Å²	72	135.4 Å²	135.4	74%	0.742	78%	0.78	S	S	*	*			trans	109.7	138	161.8	0	0	0	0	0	115.5
74	L	26.7	Very low	27.7	Very low	167 Å²	167	137.9 Å²	137.9	87%	0.874	78%	0.78	S	S	*	*			cis	-153.8	164.2	7.7	-130.3	168.1	0	0	0	110.5
75	L	26.9	Very low	27.6	Very low	166 Å²	166	136 Å²	136	87%	0.869	77%	0.774	S	S	*	*			trans	81.1	148.8	173.6	-69.4	161.6	0	0	0	119.4
76	L	25.4	Very low	27.4	Very low	166 Å²	166	133 Å²	133	87%	0.869	77%	0.771	S	S	*	*			trans	-104.9	171.2	-172.4	-73.8	161.3	0	0	0	110.6
77	P	31.4	Very low	27.5	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	77%	0.771	S	S	*	*			cis	-126.6	-173.7	9.2	41.5	-25.6	0	0	0	115.3
78	A	25.7	Very low	27.6	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	77%	0.767	S	S	*	*			trans	-76.1	172.1	-179.2	0	0	0	0	0	114.3
79	P	31.5	Very low	27.3	Very low	132 Å²	132	128.9 Å²	128.9	86%	0.857	77%	0.765	S	S	*	*				-132.8	148.6	111.8	38.1	-31.5	0	0	0	114.8
80	A	27.4	Very low	27.3	Very low	90 Å²	90	131.6 Å²	131.6	74%	0.744	77%	0.766	S	S	*	*			trans	-154.1	174.7	159.2	0	0	0	0	0	107.9
81	V	26.1	Very low	27.7	Very low	124 Å²	124	127.4 Å²	127.4	75%	0.752	77%	0.765	S	S	*	*			trans	81.5	144.8	-173.8	-171	0	0	0	0	114.1
82	E	32.8	Very low	27.6	Very low	173 Å²	173	127.8 Å²	127.8	81%	0.808	78%	0.777	S	S	*	*			trans	-85.6	-152.8	-172.3	-55.3	161.4	118.5	0	0	111.4
83	H	23.6	Very low	27.5	Very low	153 Å²	153	123 Å²	123	71%	0.708	78%	0.775	S	S	*	*			trans	91.8	149.6	175.2	-56.5	-51.6	0	0	0	117.1
84	I	25.9	Very low	27.5	Very low	138 Å²	138	125.7 Å²	125.7	71%	0.708	78%	0.782	S	S	*	*			cis	-167.9	150.3	-31.5	-141.5	171.9	0	0	0	108.1
85	V	21.6	Very low	27.5	Very low	120 Å²	120	122.6 Å²	122.6	73%	0.727	78%	0.78	S	S	*	*			trans	59.2	121.1	143.6	158.4	0	0	0	0	122.4
86	V	23.8	Very low	27.6	Very low	130 Å²	130	118.6 Å²	118.6	79%	0.788	77%	0.771	S	S	*	*			trans	96	143.4	135.5	152.2	0	0	0	0	124.7
87	T	25	Very low	27.5	Very low	123 Å²	123	116.5 Å²	116.5	76%	0.755	77%	0.766	S	S	*	*			trans	-60.8	170.3	172.9	42.4	0	0	0	0	116.8
88	A	29.2	Very low	27.1	Very low	91 Å²	91	114.6 Å²	114.6	75%	0.752	76%	0.755	S	S	*	*			cis	-172.4	-143	-15.3	0	0	0	0	0	109
89	A	29.9	Very low	27.1	Very low	81 Å²	81	116.5 Å²	116.5	67%	0.669	76%	0.758	S	S	*	*			trans	81.9	142.6	179.5	0	0	0	0	0	116.6
90	D	28.4	Very low	26.7	Very low	148 Å²	148	117.6 Å²	117.6	79%	0.791	75%	0.75	S	S	*	*			cis	-166.7	169.3	-14	-104.2	-19	0	0	0	109.2
91	S	36.5	Very low	26.5	Very low	105 Å²	105	121.3 Å²	121.3	73%	0.734	75%	0.752	S	S	*	*			cis	-179.8	139.4	-38.5	-94.9	0	0	0	0	108.9
92	S	26.9	Very low	26.4	Very low	125 Å²	125	120.8 Å²	120.8	87%	0.874	75%	0.753	S	S	*	*			trans	-160.9	129.8	171.4	64	0	0	0	0	114.7
93	G	27.2	Very low	26	Very low	74 Å²	74	117.4 Å²	117.4	76%	0.763	75%	0.749	S	S	*	*			trans	111.7	91.3	155.1	0	0	0	0	0	117.9
94	S	25.9	Very low	26.1	Very low	127 Å²	127	119.1 Å²	119.1	89%	0.888	76%	0.757	S	S	*	*			trans	52.4	102.5	148.7	-53.2	0	0	0	0	120.8
95	A	26.8	Very low	26	Very low	102 Å²	102	117.4 Å²	117.4	84%	0.843	76%	0.758	S	S	*	*			trans	-79.6	-177.4	148.3	0	0	0	0	0	110
96	A	27.7	Very low	26.1	Very low	82 Å²	82	119 Å²	119	68%	0.678	76%	0.762	S	S	*	*			cis	-151.8	-176.2	9.1	0	0	0	0	0	108.8
97	T	25.3	Very low	26.1	Very low	123 Å²	123	120.2 Å²	120.2	76%	0.755	77%	0.769	S	S	*	*			cis	-159.7	132.9	9.9	-6.2	0	0	0	0	104
98	S	23	Very low	26	Very low	79 Å²	79	121.6 Å²	121.6	55%	0.552	77%	0.767	S	S	*	*				57.6	113.4	53.2	73.4	0	0	0	0	113.7
99	T	25.1	Very low	25.7	Very low	126 Å²	126	127 Å²	127	77%	0.773	77%	0.768	S	S	*	*				86	162.9	50.5	-56.3	0	0	0	0	112.9
100	F	23.4	Very low	25.4	Very low	155 Å²	155	127.3 Å²	127.3	68%	0.68	77%	0.765	S	S	*	*			trans	100	124.7	174.8	-61.7	-79.1	0	0	0	114.2
101	Q	23.2	Very low	25.2	Very low	168 Å²	168	127 Å²	127	79%	0.785	76%	0.764	S	S	*	*				62.2	146.9	70.2	-59.6	-176.6	1.4	0	0	111.7
102	S	24.3	Very low	24.7	Very low	113 Å²	113	128 Å²	128	79%	0.79	77%	0.765	S	S	*	*			cis	-156	179.9	28.8	-163.7	0	0	0	0	113.4
103	S	23.1	Very low	24.6	Very low	103 Å²	103	127 Å²	127	72%	0.72	76%	0.758	S	S	*	*			trans	-83.7	152.6	174	-48.4	0	0	0	0	113
104	Q	26	Very low	24.4	Very low	188 Å²	188	130.7 Å²	130.7	88%	0.879	76%	0.76	S	S	*	*				156.4	144	114.6	-82.3	-162.7	12.5	0	0	116.4
105	S	23.4	Very low	24.3	Very low	103 Å²	103	131.8 Å²	131.8	72%	0.72	75%	0.754	S	S	*	*			trans	68	126.6	142.9	-161.1	0	0	0	0	124.1
106	L	23.7	Very low	24.1	Very low	154 Å²	154	133.1 Å²	133.1	81%	0.806	74%	0.743	S	S	*	*			trans	-23.4	146.6	164.7	-68.6	67.1	0	0	0	120.6
107	T	24.7	Very low	24.5	Very low	154 Å²	154	133.7 Å²	133.7	95%	0.945	74%	0.74	S	S	*	*			trans	-153.6	-177.1	130.5	-0.2	0	0	0	0	110.7
108	H	22.1	Very low	24.6	Very low	153 Å²	153	131 Å²	131	71%	0.708	72%	0.717	S	S	*	*			trans	-139.2	134	-152.9	158.2	-97.9	0	0	0	116
109	R	23.4	Very low	24.7	Very low	203 Å²	203	131.6 Å²	131.6	77%	0.766	71%	0.711	S	S	*	*			trans	99.2	138.6	149.7	-113.2	-174.7	-146	-153.1	1.3	123.8
110	S	24.4	Very low	24.8	Very low	88 Å²	88	131.5 Å²	131.5	62%	0.615	70%	0.699	S	S	*	*			trans	67.7	112.4	140.9	56	0	0	0	0	122.8
111	N	23.8	Very low	24.9	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	70%	0.701	S	S	*	*				-171.5	137.9	91.8	-92.2	-52.8	0	0	0	110.1
112	V	24.8	Very low	25.1	Very low	126 Å²	126	124.1 Å²	124.1	76%	0.764	70%	0.695	S	S	*	*				61.4	123.6	84.1	176.9	0	0	0	0	111.9
113	S	24.5	Very low	25.2	Very low	104 Å²	104	126.1 Å²	126.1	73%	0.727	70%	0.696	S	S	*	*			cis	-153.7	-177.7	7.4	-126.6	0	0	0	0	110.2
114	L	24.1	Very low	25.4	Very low	152 Å²	152	129.9 Å²	129.9	80%	0.796	70%	0.699	S	S	*	*			cis	-128.8	-102.5	5.6	-148.5	-175.8	0	0	0	112.1
115	L	24.7	Very low	25.5	Very low	149 Å²	149	132.9 Å²	132.9	78%	0.78	70%	0.702	S	S	*	*			cis	-158.6	152.6	-6.1	-142.8	-175.4	0	0	0	108.2
116	E	22.2	Very low	25.5	Very low	130 Å²	130	135.6 Å²	135.6	61%	0.607	70%	0.701	S	S	*	*			trans	-156.3	169.2	-176	-129.6	-154.8	143.9	0	0	112	Y118	E116-Y118 WeakPolarHBondContact OE1-CA 3.31Å; E116-Y118 WeakPolarHBondContact OE1-CD2 3.24Å; E116-Y118 PolarHBondContact OE1-N 2.9Å
117	P	36.3	Very low	25.6	Very low	95 Å²	95	133.7 Å²	133.7	62%	0.617	70%	0.701	S	S	*	*				-138.7	139.2	56.7	27.4	-3.9	0	0	0	119.9	Q891	P117-Q891 VanDerWaalsContact O-CB 3.31Å; P117-Q891 WeakPolarHBondContact O-CB 3.39Å; P117-Q891 WeakPolarHBondContact O-CG 3.44Å
118	Y	26.5	Very low	25.6	Very low	67 Å²	67	132.8 Å²	132.8	26%	0.263	69%	0.686	S	S	.	*			trans	69	175.9	145.8	-93.9	-118.9	0	0	0	120.5	E116 K120 D888 Q889 Q891	E116-Y118 WeakPolarHBondContact OE1-CA 3.31Å; E116-Y118 WeakPolarHBondContact OE1-CD2 3.24Å; E116-Y118 PolarHBondContact OE1-N 2.9Å; Y118-K120 HydrophobicContact CD1-CB 4.48Å; Y118-K120 HydrophobicContact CD1-CD 4.11Å; Y118-K120 HydrophobicContact CE1-CD 3.44Å; Y118-K120 VanDerWaalsContact CE1-CD 3.44Å; Y118-K120 PolarHBondContact OH-NZ 3.35Å; Y118-D888 PolarHBondContact OH-OD1 3.17Å; Y118-Q889 HydrophobicContact CE1-CG 4.45Å; Y118-Q891 VanDerWaalsContact C-CB 3.42Å; Y118-Q891 WeakPolarHBondContact O-CB 3.5Å; Y118-Q891 VanDerWaalsContact O-CG 3.24Å; Y118-Q891 WeakPolarHBondContact O-CG 3.29Å
119	Q	25.5	Very low	25.7	Very low	91 Å²	91	133.9 Å²	133.9	43%	0.425	69%	0.691	S	S	.	*			cis	-136.7	-143.4	15.3	70.3	132.8	-65.8	0	0	119	Q891	Q119-Q891 HydrophobicContact CB-CB 3.91Å; Q119-Q891 HydrophobicContact CG-CB 4.14Å; Q119-Q891 WeakPolarHBondContact CG-O 3.48Å; Q119-Q891 PolarHBondContact NE2-O 3.4Å
120	K	26.4	Very low	26.1	Very low	123 Å²	123	129.8 Å²	129.8	54%	0.535	69%	0.689	S	S	.	*			trans	-156.7	-28.2	-134.4	-150.5	151.9	177.7	174	0	121.3	Y118 D888	Y118-K120 HydrophobicContact CD1-CB 4.48Å; Y118-K120 HydrophobicContact CD1-CD 4.11Å; Y118-K120 HydrophobicContact CE1-CD 3.44Å; Y118-K120 VanDerWaalsContact CE1-CD 3.44Å; Y118-K120 PolarHBondContact OH-NZ 3.35Å; K120-D888 IonicContact NZ-OD1 3.41Å; K120-D888 PolarHBondContact NZ-OD1 3.14Å
121	C	25.9	Very low	26.2	Very low	105 Å²	105	132.9 Å²	132.9	71%	0.709	70%	0.698	S	S	*	*			trans	-155.5	144.2	-160.2	-143.2	0	0	0	0	119.2
122	G	27.3	Very low	26.4	Very low	64 Å²	64	130.2 Å²	130.2	66%	0.66	69%	0.691	S	S	*	*			cis	166.4	151.8	-14.7	0	0	0	0	0	118.2
123	L	27	Very low	26.6	Very low	155 Å²	155	132.5 Å²	132.5	81%	0.812	70%	0.699	S	S	*	*			trans	57	127.2	148.5	-74.1	163	0	0	0	124.7
124	K	25.7	Very low	26.6	Very low	182 Å²	182	131.3 Å²	131.3	79%	0.791	70%	0.703	S	S	*	*			trans	66.8	128.4	143	-75.4	178.9	175.5	178.5	0	120.9
125	R	29.3	Very low	26.9	Very low	250 Å²	250	128.9 Å²	128.9	94%	0.943	70%	0.699	S	S	*	*				-161.3	169.7	99.7	-104.1	175.1	-170.7	110	-3.3	112.9
126	K	24.1	Very low	26.9	Very low	160 Å²	160	127.6 Å²	127.6	70%	0.696	70%	0.697	S	S	*	*			trans	-115.7	145.8	173.7	149.3	-179.4	174.1	169.1	0	107.5	E128	K126-E128 WeakPolarHBondContact CE-OE2 3.22Å; K126-E128 IonicContact NZ-OE2 2.6Å; K126-E128 PolarHBondContact NZ-OE2 3.46Å
127	S	25.1	Very low	27.2	Very low	114 Å²	114	128.5 Å²	128.5	80%	0.797	70%	0.701	S	S	*	*			trans	-172.4	166.5	133.9	-107.9	0	0	0	0	112.7
128	E	23.7	Very low	26.8	Very low	136 Å²	136	131.6 Å²	131.6	64%	0.636	71%	0.711	S	S	*	*			trans	-99.4	154.7	-175.8	-70.1	135	106.6	0	0	112.7	K126	K126-E128 WeakPolarHBondContact CE-OE2 3.22Å; K126-E128 IonicContact NZ-OE2 2.6Å; K126-E128 PolarHBondContact NZ-OE2 3.46Å
129	E	26.1	Very low	26.9	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	73%	0.731	S	S	*	*			trans	44.1	138.1	144.7	-71.7	-167.6	126.7	0	0	125.1
130	V	30.7	Very low	27.1	Very low	117 Å²	117	137.3 Å²	137.3	71%	0.709	74%	0.743	S	S	*	*			trans	67	113.7	140.7	174.1	0	0	0	0	118.9
131	D	25.6	Very low	27	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	76%	0.758	S	S	*	*				-160.7	-178.4	95.2	-136.9	-36.5	0	0	0	113.1
132	S	28.3	Very low	27.2	Very low	87 Å²	87	142 Å²	142	61%	0.608	76%	0.756	S	S	*	*			trans	-121	167.6	-156	-48.2	0	0	0	0	116.9
133	N	29.8	Very low	28.4	Very low	173 Å²	173	143.7 Å²	143.7	93%	0.925	76%	0.755	S	S	*	*			trans	96.4	131.5	157.4	-54.7	-34.9	0	0	0	120.6
134	G	24.6	Very low	29	Very low	79 Å²	79	142.2 Å²	142.2	81%	0.814	76%	0.755	S	S	*	*			trans	176.9	136.6	169.4	0	0	0	0	0	109.4
135	S	29.9	Very low	29.1	Very low	102 Å²	102	140.9 Å²	140.9	71%	0.713	76%	0.756	S	S	*	*			trans	-137.3	-176.4	-151.9	57.5	0	0	0	0	117.2
136	V	25.4	Very low	29	Very low	122 Å²	122	136.3 Å²	136.3	74%	0.739	75%	0.747	S	S	*	*			trans	77.2	111.5	179.3	-171.2	0	0	0	0	115
137	Q	27.8	Very low	29.1	Very low	148 Å²	148	136.4 Å²	136.4	69%	0.692	75%	0.754	S	S	*	*			cis	92.5	109.9	6.1	-48.1	156.8	-102.2	0	0	118.5
138	I	28.5	Very low	29.3	Very low	161 Å²	161	138.9 Å²	138.9	83%	0.826	75%	0.753	S	S	*	*			trans	-142.7	114	160.1	-59.3	176.3	0	0	0	103.7
139	I	28.6	Very low	29.6	Very low	134 Å²	134	139.9 Å²	139.9	69%	0.687	76%	0.763	S	S	*	*			cis	81.9	102.9	45.5	-57.1	166.4	0	0	0	111.2
140	E	28.9	Very low	29.7	Very low	144 Å²	144	142 Å²	142	67%	0.673	76%	0.763	S	S	*	*			cis	-130.9	-111.7	-1.2	-167.1	65.5	-168.9	0	0	112.6	H142	E140-H142 IonicContact OE1-CE1 3.5Å; E140-H142 PolarHBondContact OE1-CE1 3.46Å; E140-H142 IonicContact OE1-ND1 2.7Å
141	E	24.9	Very low	29.5	Very low	181 Å²	181	142.4 Å²	142.4	85%	0.846	77%	0.766	S	S	*	*			cis	-132.6	-157.2	6.1	-152	-177.6	-113.9	0	0	111.2
142	H	29.1	Very low	29.5	Very low	144 Å²	144	141.4 Å²	141.4	67%	0.667	77%	0.765	S	S	*	*			trans	-144.2	171.8	-147.2	-100.3	39.7	0	0	0	117.8	E140	E140-H142 IonicContact OE1-CE1 3.5Å; E140-H142 PolarHBondContact OE1-CE1 3.46Å; E140-H142 IonicContact OE1-ND1 2.7Å
143	P	53.1	Low	29.4	Very low	100 Å²	100	144 Å²	144	65%	0.649	78%	0.777	S	S	*	*			trans	-97.6	-154.7	-162.7	39.8	-37.2	0	0	0	114.5
144	P	40.2	Very low	29.3	Very low	124 Å²	124	139.2 Å²	139.2	81%	0.805	77%	0.769	S	S	*	*				-138.5	158.4	109.7	39	-29.1	0	0	0	116.8
145	L	26.7	Very low	29.4	Very low	155 Å²	155	140.2 Å²	140.2	81%	0.812	77%	0.77	S	S	*	*			trans	-103.2	-174.5	164.9	-71.3	168	0	0	0	110.5
146	M	27.4	Very low	29.2	Very low	153 Å²	153	140.3 Å²	140.3	75%	0.754	78%	0.776	S	S	*	*			trans	111.2	130.5	161.5	-56.8	-97.9	74.2	0	0	113.3
147	L	27.3	Very low	29.4	Very low	162 Å²	162	139.3 Å²	139.3	85%	0.848	78%	0.781	S	S	*	*				-149.4	167.6	51.2	-109.8	102.8	0	0	0	114.2
148	Q	29.6	Very low	29.4	Very low	166 Å²	166	138.7 Å²	138.7	78%	0.776	79%	0.788	S	S	*	*			trans	-96	151.2	167.9	-62.5	173.5	-25.9	0	0	111.3
149	N	28.5	Very low	29.4	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	79%	0.789	S	S	*	*			trans	-159.6	-178.2	142.5	-130	-30	0	0	0	114.5
150	R	28.2	Very low	29.3	Very low	222 Å²	222	137.2 Å²	137.2	84%	0.838	79%	0.792	S	S	*	*			trans	-110.8	176.9	-170.9	-56.2	177.7	-174.7	167	2.7	110.3
151	T	26.9	Very low	29.2	Very low	125 Å²	125	136.1 Å²	136.1	77%	0.767	80%	0.796	S	S	*	*			cis	-158	171	24.3	-36.4	0	0	0	0	112.2
152	V	26.7	Very low	29.4	Very low	130 Å²	130	133.7 Å²	133.7	79%	0.788	79%	0.793	S	S	*	*			trans	-34.9	136.6	154.6	-173.5	0	0	0	0	111.2
153	V	26	Very low	29.3	Very low	141 Å²	141	132.7 Å²	132.7	86%	0.855	80%	0.797	S	S	*	*				-153.5	157.1	61.8	-179.8	0	0	0	0	110.4
154	G	26.1	Very low	28.3	Very low	74 Å²	74	134 Å²	134	76%	0.763	80%	0.804	S	S	*	*			trans	138.4	108.8	149.1	0	0	0	0	0	117.3
155	A	27.2	Very low	27.8	Very low	100 Å²	100	138.1 Å²	138.1	83%	0.826	81%	0.809	S	S	*	*			trans	-71.1	153.3	-169.9	0	0	0	0	0	118.3
156	A	26.5	Very low	28.1	Very low	103 Å²	103	135.5 Å²	135.5	85%	0.851	80%	0.804	S	S	*	*			trans	68.9	108.7	139.3	0	0	0	0	0	122
157	A	29.5	Very low	28.5	Very low	102 Å²	102	133.3 Å²	133.3	84%	0.843	80%	0.803	S	S	*	*				-152.1	137.1	128	0	0	0	0	0	110
158	T	27.2	Very low	28.8	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	80%	0.801	S	S	*	*			trans	-99.8	130.1	-179.8	-55.6	0	0	0	0	110.8
159	T	28.9	Very low	29.3	Very low	138 Å²	138	128.6 Å²	128.6	85%	0.847	80%	0.803	S	S	*	*			trans	-137.8	134.1	161.8	-56.6	0	0	0	0	109.7
160	T	27.3	Very low	30.3	Very low	125 Å²	125	126.7 Å²	126.7	77%	0.767	80%	0.801	S	S	*	*			trans	-85.2	121.6	-163.6	-36.7	0	0	0	0	113
161	T	26	Very low	31.7	Very low	121 Å²	121	117.4 Å²	117.4	74%	0.742	78%	0.775	S	S	*	*			trans	-76.7	118.6	166.6	48.8	0	0	0	0	110.8
162	V	29.4	Very low	33.7	Very low	130 Å²	130	119.2 Å²	119.2	79%	0.788	77%	0.774	S	S	*	*			trans	-82.6	113.8	169.5	177.4	0	0	0	0	109	T164	V162-T164 PolarHBondContact O-N 3.43Å
163	T	27.3	Very low	36.3	Very low	123 Å²	123	114 Å²	114	76%	0.755	75%	0.747	S	S	*	*			trans	-87.2	97	177.7	38.4	0	0	0	0	111.3	K165	T163-K165 PolarHBondContact O-N 2.6Å
164	T	31	Very low	39.1	Very low	129 Å²	129	108.9 Å²	108.9	79%	0.791	72%	0.715	S	S	*	*			trans	-68.5	106.7	166.1	38.2	0	0	0	0	109.8	V162 S166	V162-T164 PolarHBondContact O-N 3.43Å; T164-S166 PolarHBondContact O-N 2.89Å
165	K	29.5	Very low	42.2	Very low	209 Å²	209	106 Å²	106	91%	0.909	68%	0.681	S	S	*	*			trans	-64.9	130.8	171.2	-73.6	-172.8	176	-177	0	109.6	T163	T163-K165 PolarHBondContact O-N 2.6Å
166	S	33.7	Very low	45.2	Very low	101 Å²	101	109 Å²	109	71%	0.706	68%	0.678	S	S	*	*			trans	-88.4	164.3	-173.1	58.6	0	0	0	0	113.7	T164	T164-S166 PolarHBondContact O-N 2.89Å
167	S	36	Very low	48.3	Very low	106 Å²	106	106.1 Å²	106.1	74%	0.741	65%	0.648	S	S	*	*			trans	55.8	77.6	153.2	59.4	0	0	0	0	117.7
168	S	33.8	Very low	51.3	Low	116 Å²	116	104.8 Å²	104.8	81%	0.811	63%	0.629	S	S	*	*	S	Bend		-75	158.3	122.7	55.8	0	0	0	0	108.8	S170	S168-S170 PolarHBondContact O-N 2.69Å; S168-S170 VanDerWaalsContact O-N 3.16Å
169	S	39.7	Very low	54.5	Low	114 Å²	114	104.2 Å²	104.2	80%	0.797	62%	0.617	S	S	*	*			trans	-56.2	118	-167.9	54.5	0	0	0	0	113.6	G171	S169-G171 PolarHBondContact O-N 3.19Å; S169-G171 VanDerWaalsContact O-N 3.11Å
170	S	48.5	Very low	57.6	Low	116 Å²	116	103 Å²	103	81%	0.811	60%	0.601	S	S	*	*			trans	-58.5	113.3	163	-61	0	0	0	0	108.6	S168	S168-S170 PolarHBondContact O-N 2.69Å; S168-S170 VanDerWaalsContact O-N 3.16Å
171	G	57.5	Low	60.8	Low	27 Å²	27	98.9 Å²	98.9	28%	0.278	57%	0.573	S	S	.	*			trans	-61.9	137.5	179.8	0	0	0	0	0	110.9	S169 G173 D174	S169-G171 PolarHBondContact O-N 3.19Å; S169-G171 VanDerWaalsContact O-N 3.11Å; G171-G173 PolarHBondContact O-N 3.11Å; G171-D174 PolarHBondContact O-N 3.12Å
172	E	70.8	Confident	64.1	Low	164 Å²	164	95.5 Å²	95.5	77%	0.766	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	112.9	-178.9	-167.5	174.5	174.7	0	0	110.4
173	G	79.4	Confident	67.3	Low	20 Å²	20	89.3 Å²	89.3	21%	0.206	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	10.7	-175.8	0	0	0	0	0	116.6	G171 K222 N223 H263	G171-G173 PolarHBondContact O-N 3.11Å; G173-K222 CarbonylContact O-C 3.58Å; G173-K222 WeakPolarHBondContact O-CA 3.21Å; G173-K222 WeakPolarHBondContact O-CB 3.46Å; G173-N223 VanDerWaalsContact CA-O 3.25Å; G173-N223 WeakPolarHBondContact CA-O 3.38Å; G173-N223 PolarHBondContact O-N 2.88Å; G173-H263 PolarHBondContact O-CE1 2.97Å; G173-H263 VanDerWaalsContact O-CE1 3.22Å
174	D	85.4	Confident	70.5	Confident	34 Å²	34	86.6 Å²	86.6	18%	0.182	50%	0.498	C	S	.	.			trans	-77.7	142	167.5	-86.3	-62.2	0	0	0	111.9	G171 R198 K222	G171-D174 PolarHBondContact O-N 3.12Å; D174-R198 VanDerWaalsContact CG-NH2 3.32Å; D174-R198 IonicContact OD1-NE 3.03Å; D174-R198 PolarHBondContact OD1-NE 3Å; D174-R198 IonicContact OD1-NH2 3.98Å; D174-R198 IonicContact OD2-CZ 2.65Å; D174-R198 IonicContact OD2-NE 3.72Å; D174-R198 IonicContact OD2-NH2 1.8Å; D174-R198 PolarHBondContact OD2-NH2 3.4Å; D174-K222 WeakPolarHBondContact OD1-CE 3.38Å; D174-K222 IonicContact OD1-NZ 2.6Å; D174-K222 PolarHBondContact OD1-NZ 3.27Å; D174-K222 IonicContact OD2-NZ 3.77Å; D174-K222 PolarHBondContact OD2-NZ 3.46Å
175	Y	90.6	Very high	73.4	Confident	14 Å²	14	81.6 Å²	81.6	6%	0.055	47%	0.469	C	S	.	.			trans	-82.3	126.7	177.2	-174.4	-88.7	0	0	0	111	L177 E181 L183 Q203 I220 H260 K261 H263	Y175-L177 HydrophobicContact CD1-CB 4.4Å; Y175-L177 HydrophobicContact CD1-CD1 4.37Å; Y175-L177 HydrophobicContact CE1-CD1 4.29Å; Y175-L177 PolarHBondContact O-N 3.48Å; Y175-E181 WeakPolarHBondContact CE1-OE2 3.29Å; Y175-E181 PolarHBondContact OH-OE1 3.07Å; Y175-E181 PolarHBondContact OH-OE2 3.43Å; Y175-L183 HydrophobicContact CE1-CD2 4.41Å; Y175-Q203 PolarHBondContact O-NE2 3.2Å; Y175-Q203 PolarHBondContact O-OE1 2.81Å; Y175-I220 HydrophobicContact CD1-CD1 3.95Å; Y175-I220 HydrophobicContact CD1-CG2 4.49Å; Y175-I220 HydrophobicContact CD2-CG2 4.18Å; Y175-I220 HydrophobicContact CE1-CD1 4.26Å; Y175-I220 HydrophobicContact CG-CD1 4.4Å; Y175-I220 HydrophobicContact CG-CG2 3.9Å; Y175-H260 AromaticContact CE2-CD2 3.99Å; Y175-H260 PolarHBondContact OH-CD2 2.96Å; Y175-K261 HydrophobicContact CE2-CB 4.35Å; Y175-K261 HydrophobicContact CE2-CD 4.01Å; Y175-K261 PolarHBondContact OH-NZ 3.05Å; Y175-H263 HydrophobicContact CD2-CB 4.39Å; Y175-H263 AromaticContact CD2-CD2 3.58Å; Y175-H263 AromaticContact CD2-CG 3.85Å; Y175-H263 AromaticContact CD2-NE2 3.82Å
176	Q	90.9	Very high	76.2	Confident	163 Å²	163	80.9 Å²	80.9	76%	0.762	47%	0.471	S	S	*	.			trans	-76.8	93.9	173.7	-171.7	173.3	9.6	0	0	110.5	V178	Q176-V178 PolarHBondContact O-N 3.18Å
177	L	90.9	Very high	78.9	Confident	42 Å²	42	80.9 Å²	80.9	22%	0.22	47%	0.467	C	S	.	.			trans	-69.6	127	178.7	-166.8	70.7	0	0	0	110.9	Y175 V192 F195 A205 I220	Y175-L177 HydrophobicContact CD1-CB 4.4Å; Y175-L177 HydrophobicContact CD1-CD1 4.37Å; Y175-L177 HydrophobicContact CE1-CD1 4.29Å; Y175-L177 PolarHBondContact O-N 3.48Å; L177-V192 HydrophobicContact CD1-CB 4.49Å; L177-V192 HydrophobicContact CD1-CG1 3.76Å; L177-V192 HydrophobicContact CD1-CG2 3.88Å; L177-V192 HydrophobicContact CD2-CG1 4.08Å; L177-V192 HydrophobicContact CG-CG1 3.88Å; L177-F195 HydrophobicContact CD2-CB 4.04Å; L177-F195 HydrophobicContact CD2-CD2 4.1Å; L177-A205 HydrophobicContact CD1-CB 3.98Å; L177-A205 HydrophobicContact CD2-CB 3.84Å; L177-I220 HydrophobicContact CD1-CD1 3.91Å
178	V	93.3	Very high	81.6	Confident	74 Å²	74	77 Å²	77	45%	0.448	44%	0.438	S	S	.	.			trans	-116.4	133.1	174.7	178.2	0	0	0	0	109.2	Q176 E181 V192	Q176-V178 PolarHBondContact O-N 3.18Å; V178-E181 HydrophobicContact CB-CB 4.13Å; V178-E181 WeakPolarHBondContact O-CB 3.28Å; V178-E181 PolarHBondContact O-N 3.37Å; V178-V192 WeakPolarHBondContact O-CB 3.35Å
179	Q	93.8	Very high	84.6	Confident	123 Å²	123	73.6 Å²	73.6	58%	0.575	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	140	177.3	-157.3	-173.6	16.8	0	0	110.4	E181 L193	Q179-E181 PolarHBondContact O-N 2.89Å; Q179-L193 WeakPolarHBondContact CG-O 3.5Å; Q179-L193 PolarHBondContact NE2-O 2.67Å
180	H	94.3	Very high	87.4	Confident	112 Å²	112	68.2 Å²	68.2	52%	0.519	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	13.2	-170.6	-42.6	91.5	0	0	0	114.7	E191 V192	H180-E191 IonicContact CD2-OE1 3.92Å; H180-V192 WeakPolarHBondContact CA-O 3.32Å; H180-V192 PolarHBondContact N-O 3.44Å
181	E	95.3	Very high	89.7	Confident	38 Å²	38	64.6 Å²	64.6	18%	0.178	35%	0.346	C	S	.	.			trans	-67.8	143.9	168.1	179.2	165.4	-121.6	0	0	111.4	Y175 V178 Q179 L183 E191 V192 K261	Y175-E181 WeakPolarHBondContact CE1-OE2 3.29Å; Y175-E181 PolarHBondContact OH-OE1 3.07Å; Y175-E181 PolarHBondContact OH-OE2 3.43Å; V178-E181 HydrophobicContact CB-CB 4.13Å; V178-E181 WeakPolarHBondContact O-CB 3.28Å; V178-E181 PolarHBondContact O-N 3.37Å; Q179-E181 PolarHBondContact O-N 2.89Å; E181-L183 HydrophobicContact CG-CD2 4.47Å; E181-E191 CarbonylContact O-C 3.57Å; E181-E191 WeakPolarHBondContact O-CA 3.44Å; E181-V192 HydrophobicContact CB-CG2 4.32Å; E181-V192 PolarHBondContact O-N 3.4Å; E181-K261 IonicContact OE1-NZ 3.84Å; E181-K261 PolarHBondContact OE1-NZ 3.12Å; E181-K261 IonicContact OE2-NZ 3.35Å
182	I	95.8	Very high	91.6	Very high	51 Å²	51	63.4 Å²	63.4	26%	0.262	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	108.6	174.1	-50.2	-55.8	0	0	0	110.2	C184 Y190 E191	I182-C184 PolarHBondContact O-N 3.32Å; I182-Y190 CarbonylContact C-O 3.55Å; I182-Y190 WeakPolarHBondContact CA-O 3.24Å; I182-E191 HydrophobicContact CD1-CB 3.66Å; I182-E191 HydrophobicContact CD1-CG 3.76Å
183	L	95.9	Very high	92.8	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	110.8	166.8	-52.2	176.6	0	0	0	108.4	Y175 E181 Y190 V192 I218 I220 F258	Y175-L183 HydrophobicContact CE1-CD2 4.41Å; E181-L183 HydrophobicContact CG-CD2 4.47Å; L183-Y190 PolarHBondContact N-O 2.78Å; L183-Y190 PolarHBondContact O-N 3.45Å; L183-V192 HydrophobicContact CD1-CG2 3.94Å; L183-V192 HydrophobicContact CD2-CG2 4.5Å; L183-V192 HydrophobicContact CG-CG2 3.94Å; L183-I218 HydrophobicContact CD1-CD1 4.35Å; L183-I218 HydrophobicContact CD1-CG2 4.37Å; L183-I220 HydrophobicContact CD1-CD1 3.95Å; L183-F258 HydrophobicContact CB-CE2 4.34Å; L183-F258 HydrophobicContact CB-CZ 4.11Å
184	C	93.7	Very high	93.6	Very high	65 Å²	65	61.5 Å²	61.5	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	127.2	177.9	-63	0	0	0	0	111.5	I182 F258 H260	I182-C184 PolarHBondContact O-N 3.32Å; C184-F258 WeakPolarHBondContact O-CD2 3.5Å; C184-F258 VanDerWaalsContact O-CE2 3.28Å; C184-F258 WeakPolarHBondContact O-CE2 3.49Å; C184-H260 PolarHBondContact N-ND1 2.66Å
185	S	93.1	Very high	94.1	Very high	25 Å²	25	65.3 Å²	65.3	18%	0.175	34%	0.336	C	S	.	.			trans	-97.9	177.7	161.7	178.5	0	0	0	0	109.6	T187 N188 E256	S185-T187 PolarHBondContact O-N 3.47Å; S185-N188 WeakPolarHBondContact CB-O 3.47Å; S185-N188 PolarHBondContact N-O 2.99Å; S185-E256 WeakPolarHBondContact CB-OE1 3.23Å; S185-E256 PolarHBondContact OG-OE1 3.01Å
186	M	88.6	Confident	94.2	Very high	193 Å²	193	68.1 Å²	68.1	95%	0.951	35%	0.352	S	S	*	.	S	Bend	trans	-69	-23.6	175.1	-64.2	-172.2	72.4	0	0	113.2
187	T	88.8	Confident	94.1	Very high	102 Å²	102	61.6 Å²	61.6	63%	0.626	33%	0.328	S	S	*	.	S	Bend	trans	-118.7	-22.9	-171.1	47.1	0	0	0	0	113.5	S185 E256	S185-T187 PolarHBondContact O-N 3.47Å; T187-E256 PolarHBondContact OG1-OE2 3.48Å; T187-E256 VanDerWaalsContact OG1-OE2 3.12Å
188	N	94.4	Very high	94	Very high	24 Å²	24	66.6 Å²	66.6	13%	0.128	34%	0.344	C	S	.	.			trans	-141.6	157.2	-165.5	-75.4	-62.4	0	0	0	111.7	S185 Y190 S211 E256	S185-N188 WeakPolarHBondContact CB-O 3.47Å; S185-N188 PolarHBondContact N-O 2.99Å; N188-Y190 HydrophobicContact CB-CD2 4.24Å; N188-Y190 HydrophobicContact CB-CE2 3.45Å; N188-Y190 VanDerWaalsContact CB-CE2 3.45Å; N188-S211 PolarHBondContact OD1-OG 2.92Å; N188-E256 PolarHBondContact ND2-OE2 3.48Å
189	S	95.8	Very high	93.5	Very high	45 Å²	45	65.2 Å²	65.2	32%	0.315	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128	171.9	-57.2	0	0	0	0	109.7	R210	S189-R210 PolarHBondContact O-N 3.01Å
190	Y	97.6	Very high	93	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	116.5	-172.7	-62.5	-84.6	0	0	0	110.3	I182 L183 N188 W208 K209 V216 I218 E256 F258 V267	I182-Y190 CarbonylContact C-O 3.55Å; I182-Y190 WeakPolarHBondContact CA-O 3.24Å; L183-Y190 PolarHBondContact N-O 2.78Å; L183-Y190 PolarHBondContact O-N 3.45Å; N188-Y190 HydrophobicContact CB-CD2 4.24Å; N188-Y190 HydrophobicContact CB-CE2 3.45Å; N188-Y190 VanDerWaalsContact CB-CE2 3.45Å; Y190-W208 WeakPolarHBondContact CA-O 2.86Å; Y190-K209 HydrophobicContact CD1-CB 3.79Å; Y190-K209 HydrophobicContact CD1-CG 4.1Å; Y190-K209 HydrophobicContact CE1-CB 3.68Å; Y190-K209 HydrophobicContact CE1-CD 3.8Å; Y190-K209 HydrophobicContact CE1-CG 3.59Å; Y190-V216 HydrophobicContact CD1-CG2 3.66Å; Y190-V216 HydrophobicContact CE1-CG2 3.78Å; Y190-I218 HydrophobicContact CD1-CD1 3.75Å; Y190-I218 HydrophobicContact CD2-CD1 4.06Å; Y190-I218 HydrophobicContact CE1-CD1 4.38Å; Y190-I218 HydrophobicContact CG-CD1 3.55Å; Y190-E256 PolarHBondContact OH-OE1 3.2Å; Y190-E256 PolarHBondContact OH-OE2 2.83Å; Y190-F258 HydrophobicContact CD2-CE1 4.14Å; Y190-F258 HydrophobicContact CD2-CZ 4.09Å; Y190-F258 HydrophobicContact CE2-CE1 4.03Å; Y190-F258 HydrophobicContact CE2-CZ 4.42Å; Y190-V267 HydrophobicContact CE1-CG1 3.9Å; Y190-V267 HydrophobicContact CE2-CG2 4.21Å
191	E	97.5	Very high	92.3	Very high	41 Å²	41	59.6 Å²	59.6	19%	0.192	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	122.3	178.8	-175.1	173.3	152.5	0	0	110.3	H180 E181 I182 L193 C207 W208 R210	H180-E191 IonicContact CD2-OE1 3.92Å; E181-E191 CarbonylContact O-C 3.57Å; E181-E191 WeakPolarHBondContact O-CA 3.44Å; I182-E191 HydrophobicContact CD1-CB 3.66Å; I182-E191 HydrophobicContact CD1-CG 3.76Å; E191-L193 PolarHBondContact O-N 2.56Å; E191-C207 CarbonylContact O-C 3.06Å; E191-C207 WeakPolarHBondContact O-CA 3.47Å; E191-W208 HydrophobicContact CB-CB 4.38Å; E191-W208 HydrophobicContact CB-CE3 4.44Å; E191-W208 PolarHBondContact N-O 3.38Å; E191-W208 PolarHBondContact O-N 2.75Å; E191-R210 HydrophobicContact CB-CG 4.37Å
192	V	97.4	Very high	92.1	Very high	2 Å²	2	58 Å²	58	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	113.8	179.9	176.2	0	0	0	0	110.1	L177 V178 H180 E181 L183 A205	L177-V192 HydrophobicContact CD1-CB 4.49Å; L177-V192 HydrophobicContact CD1-CG1 3.76Å; L177-V192 HydrophobicContact CD1-CG2 3.88Å; L177-V192 HydrophobicContact CD2-CG1 4.08Å; L177-V192 HydrophobicContact CG-CG1 3.88Å; V178-V192 WeakPolarHBondContact O-CB 3.35Å; H180-V192 WeakPolarHBondContact CA-O 3.32Å; H180-V192 PolarHBondContact N-O 3.44Å; E181-V192 HydrophobicContact CB-CG2 4.32Å; E181-V192 PolarHBondContact O-N 3.4Å; L183-V192 HydrophobicContact CD1-CG2 3.94Å; L183-V192 HydrophobicContact CD2-CG2 4.5Å; L183-V192 HydrophobicContact CG-CG2 3.94Å; V192-A205 HydrophobicContact CG1-CB 4.38Å
193	L	96.9	Very high	92	Very high	50 Å²	50	56.2 Å²	56.2	26%	0.262	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-42	177.7	-59.8	-174	0	0	0	112.7	Q179 E191 K206 W208 I215	Q179-L193 WeakPolarHBondContact CG-O 3.5Å; Q179-L193 PolarHBondContact NE2-O 2.67Å; E191-L193 PolarHBondContact O-N 2.56Å; L193-K206 PolarHBondContact N-O 3.22Å; L193-W208 HydrophobicContact CD1-CB 4.07Å; L193-W208 HydrophobicContact CD2-CB 4.09Å; L193-W208 HydrophobicContact CG-CB 4.1Å; L193-I215 HydrophobicContact CD1-CD1 3.66Å
194	E	95.8	Very high	91.9	Very high	94 Å²	94	58.4 Å²	58.4	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	147.7	-165.4	-161.5	174.1	-173.8	0	0	110.7	A205 K206	E194-A205 CarbonylContact O-C 3.58Å; E194-A205 WeakPolarHBondContact O-CA 3.18Å; E194-K206 HydrophobicContact CB-CB 3.84Å; E194-K206 HydrophobicContact CB-CD 3.84Å; E194-K206 HydrophobicContact CB-CG 4.5Å; E194-K206 PolarHBondContact N-O 2.81Å; E194-K206 PolarHBondContact O-N 2.92Å; E194-K206 WeakPolarHBondContact OE2-CD 3.22Å; E194-K206 WeakPolarHBondContact OE2-CE 3.48Å; E194-K206 IonicContact OE2-NZ 2.73Å; E194-K206 PolarHBondContact OE2-NZ 3.29Å
195	F	95.6	Very high	92.1	Very high	113 Å²	113	55.3 Å²	55.3	50%	0.496	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	126.3	169.3	167.9	-94.7	0	0	0	109.2	L177 G197 R198 Q203	L177-F195 HydrophobicContact CD2-CB 4.04Å; L177-F195 HydrophobicContact CD2-CD2 4.1Å; F195-G197 VanDerWaalsContact CE2-O 3.29Å; F195-G197 WeakPolarHBondContact CE2-O 3.37Å; F195-R198 HydrophobicContact CE2-CB 3.96Å; F195-R198 HydrophobicContact CZ-CB 3.71Å; F195-Q203 HydrophobicContact CE2-CB 4.22Å
196	L	92.9	Very high	92.3	Very high	74 Å²	74	56.9 Å²	56.9	39%	0.387	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-33.6	-178.2	-64.2	176.1	0	0	0	113	V204 K206 A217 M270	L196-V204 HydrophobicContact CB-CB 4.36Å; L196-V204 HydrophobicContact CB-CG1 4.39Å; L196-V204 WeakPolarHBondContact CB-O 3.05Å; L196-V204 HydrophobicContact CD1-CG1 4.17Å; L196-V204 PolarHBondContact N-O 2.87Å; L196-K206 HydrophobicContact CD1-CB 3.89Å; L196-K206 HydrophobicContact CD2-CB 4.05Å; L196-K206 HydrophobicContact CD2-CD 4.35Å; L196-K206 HydrophobicContact CG-CB 3.91Å; L196-A217 HydrophobicContact CD1-CB 4.44Å; L196-M270 HydrophobicContact CD1-CE 3.82Å; L196-M270 HydrophobicContact CD1-SD 3.95Å; L196-M270 HydrophobicContact CD2-CE 4.07Å
197	G	89.6	Confident	92.7	Very high	25 Å²	25	47.7 Å²	47.7	26%	0.258	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.5	166.7	179.9	0	0	0	0	0	114.2	F195 Q203 V204	F195-G197 VanDerWaalsContact CE2-O 3.29Å; F195-G197 WeakPolarHBondContact CE2-O 3.37Å; G197-Q203 CarbonylContact O-C 3.15Å; G197-Q203 VanDerWaalsContact O-CA 3.31Å; G197-Q203 WeakPolarHBondContact O-CA 3.43Å; G197-Q203 WeakPolarHBondContact O-CB 3.38Å; G197-V204 PolarHBondContact N-O 3.09Å; G197-V204 PolarHBondContact O-N 2.89Å
198	R	88.4	Confident	93.1	Very high	147 Å²	147	46.7 Å²	46.7	56%	0.555	24%	0.244	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	139.2	177.3	-178.6	172.7	176.1	-138.5	5.5	109.3	D174 F195 Q203	D174-R198 VanDerWaalsContact CG-NH2 3.32Å; D174-R198 IonicContact OD1-NE 3.03Å; D174-R198 PolarHBondContact OD1-NE 3Å; D174-R198 IonicContact OD1-NH2 3.98Å; D174-R198 IonicContact OD2-CZ 2.65Å; D174-R198 IonicContact OD2-NE 3.72Å; D174-R198 IonicContact OD2-NH2 1.8Å; D174-R198 PolarHBondContact OD2-NH2 3.4Å; F195-R198 HydrophobicContact CE2-CB 3.96Å; F195-R198 HydrophobicContact CZ-CB 3.71Å; R198-Q203 HydrophobicContact CB-CB 4.18Å; R198-Q203 HydrophobicContact CG-CB 4.27Å
199	G	82.8	Confident	93.3	Very high	46 Å²	46	46.9 Å²	46.9	47%	0.474	24%	0.243	S	C	.	.			trans	-134	-167.8	177.2	0	0	0	0	0	111.7	F201 G202	G199-F201 VanDerWaalsContact C-N 3.35Å; G199-F201 PolarHBondContact O-N 3.22Å; G199-G202 PolarHBondContact N-O 3.3Å
200	T	81.9	Confident	93.2	Very high	74 Å²	74	51 Å²	51	45%	0.454	25%	0.252	S	S	.	.	S	Bend	trans	-59.3	-42.5	178	45.9	0	0	0	0	112.7	K222	T200-K222 VanDerWaalsContact O-CE 3.22Å; T200-K222 WeakPolarHBondContact O-CE 3.47Å
201	F	81.5	Confident	92.9	Very high	42 Å²	42	54.4 Å²	54.4	18%	0.184	28%	0.276	C	S	.	.	S	Bend	trans	-85.7	-12.8	-172.4	-52.2	-63.4	0	0	0	115	G199 L221 K222 Y227 Q230	G199-F201 VanDerWaalsContact C-N 3.35Å; G199-F201 PolarHBondContact O-N 3.22Å; F201-L221 HydrophobicContact CB-CD2 4.49Å; F201-L221 WeakPolarHBondContact O-CA 3.43Å; F201-K222 PolarHBondContact O-N 3.37Å; F201-Y227 AromaticContact CD1-CD1 4Å; F201-Y227 HydrophobicContact CD1-CD1 4Å; F201-Y227 HydrophobicContact CD1-CE1 4.44Å; F201-Q230 HydrophobicContact CD1-CG 4.45Å; F201-Q230 HydrophobicContact CE1-CG 4.16Å
202	G	89.7	Confident	92.7	Very high	6 Å²	6	55.7 Å²	55.7	6%	0.062	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.5	-151.6	-171.8	0	0	0	0	0	113	G199 I220	G199-G202 PolarHBondContact N-O 3.3Å; G202-I220 VanDerWaalsContact CA-O 3.3Å; G202-I220 WeakPolarHBondContact CA-O 3.26Å
203	Q	93.1	Very high	92.5	Very high	13 Å²	13	63 Å²	63	6%	0.061	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	155.9	-175	64.6	-161.1	24.4	0	0	112	Y175 F195 G197 R198 K219 I220	Y175-Q203 PolarHBondContact O-NE2 3.2Å; Y175-Q203 PolarHBondContact O-OE1 2.81Å; F195-Q203 HydrophobicContact CE2-CB 4.22Å; G197-Q203 CarbonylContact O-C 3.15Å; G197-Q203 VanDerWaalsContact O-CA 3.31Å; G197-Q203 WeakPolarHBondContact O-CA 3.43Å; G197-Q203 WeakPolarHBondContact O-CB 3.38Å; R198-Q203 HydrophobicContact CB-CB 4.18Å; R198-Q203 HydrophobicContact CG-CB 4.27Å; Q203-K219 CarbonylContact O-C 3.04Å; Q203-K219 WeakPolarHBondContact O-CA 3.45Å; Q203-I220 HydrophobicContact CG-CB 4.26Å; Q203-I220 PolarHBondContact N-O 2.85Å; Q203-I220 PolarHBondContact O-N 3.41Å
204	V	95.4	Very high	92.4	Very high	45 Å²	45	64.5 Å²	64.5	27%	0.273	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.7	-179.3	-168.7	0	0	0	0	109.5	L196 G197 A217 I218 K219	L196-V204 HydrophobicContact CB-CB 4.36Å; L196-V204 HydrophobicContact CB-CG1 4.39Å; L196-V204 WeakPolarHBondContact CB-O 3.05Å; L196-V204 HydrophobicContact CD1-CG1 4.17Å; L196-V204 PolarHBondContact N-O 2.87Å; G197-V204 PolarHBondContact N-O 3.09Å; G197-V204 PolarHBondContact O-N 2.89Å; V204-A217 HydrophobicContact CG1-CB 4.12Å; V204-I218 WeakPolarHBondContact CA-O 3.46Å; V204-K219 HydrophobicContact CG2-CB 4.21Å; V204-K219 HydrophobicContact CG2-CG 4.18Å
205	A	96.9	Very high	92.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.7	175	0	0	0	0	0	110.7	L177 V192 E194 A217 I218	L177-A205 HydrophobicContact CD1-CB 3.98Å; L177-A205 HydrophobicContact CD2-CB 3.84Å; V192-A205 HydrophobicContact CG1-CB 4.38Å; E194-A205 CarbonylContact O-C 3.58Å; E194-A205 WeakPolarHBondContact O-CA 3.18Å; A205-A217 CarbonylContact O-C 2.83Å; A205-A217 WeakPolarHBondContact O-CA 3.46Å; A205-I218 PolarHBondContact N-O 2.94Å; A205-I218 PolarHBondContact O-N 3.22Å
206	K	97.4	Very high	92.6	Very high	59 Å²	59	58 Å²	58	26%	0.257	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	124.3	166.3	-169.8	-180	-174.4	168.6	0	107.3	L193 E194 L196 I215 M270	L193-K206 PolarHBondContact N-O 3.22Å; E194-K206 HydrophobicContact CB-CB 3.84Å; E194-K206 HydrophobicContact CB-CD 3.84Å; E194-K206 HydrophobicContact CB-CG 4.5Å; E194-K206 PolarHBondContact N-O 2.81Å; E194-K206 PolarHBondContact O-N 2.92Å; E194-K206 WeakPolarHBondContact OE2-CD 3.22Å; E194-K206 WeakPolarHBondContact OE2-CE 3.48Å; E194-K206 IonicContact OE2-NZ 2.73Å; E194-K206 PolarHBondContact OE2-NZ 3.29Å; L196-K206 HydrophobicContact CD1-CB 3.89Å; L196-K206 HydrophobicContact CD2-CB 4.05Å; L196-K206 HydrophobicContact CD2-CD 4.35Å; L196-K206 HydrophobicContact CG-CB 3.91Å; K206-I215 HydrophobicContact CG-CG2 3.82Å; K206-M270 HydrophobicContact CD-CE 4.29Å; K206-M270 HydrophobicContact CG-CE 4.22Å; K206-M270 HydrophobicContact CG-SD 4.07Å
207	C	97.8	Very high	92.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.2	-177.1	-61.8	0	0	0	0	112	E191 I215 V216 I218	E191-C207 CarbonylContact O-C 3.06Å; E191-C207 WeakPolarHBondContact O-CA 3.47Å; C207-I215 WeakPolarHBondContact O-CA 3.43Å; C207-V216 HydrophobicContact CB-CG2 4Å; C207-V216 PolarHBondContact N-O 3.04Å; C207-V216 WeakPolarHBondContact O-CG2 3.43Å; C207-V216 PolarHBondContact O-N 2.93Å; C207-I218 HydrophobicContact CB-CD1 3.76Å; C207-I218 HydrophobicContact CB-CG1 4.06Å
208	W	97.7	Very high	93.2	Very high	81 Å²	81	53.9 Å²	53.9	31%	0.307	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	116.7	171.9	-175.7	51.5	0	0	0	110.1	Y190 E191 L193 R210 K213 I215	Y190-W208 WeakPolarHBondContact CA-O 2.86Å; E191-W208 HydrophobicContact CB-CB 4.38Å; E191-W208 HydrophobicContact CB-CE3 4.44Å; E191-W208 PolarHBondContact N-O 3.38Å; E191-W208 PolarHBondContact O-N 2.75Å; L193-W208 HydrophobicContact CD1-CB 4.07Å; L193-W208 HydrophobicContact CD2-CB 4.09Å; L193-W208 HydrophobicContact CG-CB 4.1Å; W208-R210 HydrophobicContact CE3-CG 3.84Å; W208-R210 HydrophobicContact CZ3-CG 4.01Å; W208-R210 PolarHBondContact O-N 3.38Å; W208-K213 HydrophobicContact CZ2-CB 4.14Å; W208-K213 HydrophobicContact CZ2-CD 4.45Å; W208-K213 HydrophobicContact CZ2-CG 3.94Å; W208-K213 VanDerWaalsContact NE1-CA 3.3Å; W208-K213 PolarHBondContact NE1-O 2.85Å; W208-K213 VanDerWaalsContact NE1-O 3.1Å; W208-I215 HydrophobicContact CB-CD1 4.34Å; W208-I215 HydrophobicContact CG-CD1 4.48Å
209	K	96.8	Very high	93.5	Very high	27 Å²	27	47.8 Å²	47.8	12%	0.117	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	99.9	178.4	-179.9	176.8	158.5	-159.5	0	108.9	Y190 S211 T212 K213 E214	Y190-K209 HydrophobicContact CD1-CB 3.79Å; Y190-K209 HydrophobicContact CD1-CG 4.1Å; Y190-K209 HydrophobicContact CE1-CB 3.68Å; Y190-K209 HydrophobicContact CE1-CD 3.8Å; Y190-K209 HydrophobicContact CE1-CG 3.59Å; K209-S211 WeakPolarHBondContact CG-OG 3.44Å; K209-S211 PolarHBondContact O-N 2.84Å; K209-S211 VanDerWaalsContact O-N 3.09Å; K209-T212 WeakPolarHBondContact CD-OG1 3.25Å; K209-T212 WeakPolarHBondContact CE-OG1 3.39Å; K209-T212 WeakPolarHBondContact CG-OG1 3.4Å; K209-T212 PolarHBondContact NZ-OG1 3.15Å; K209-T212 PolarHBondContact O-N 3.4Å; K209-K213 VanDerWaalsContact O-CA 3.28Å; K209-K213 WeakPolarHBondContact O-CA 3.28Å; K209-K213 PolarHBondContact O-N 3.09Å; K209-E214 HydrophobicContact CB-CB 4.47Å; K209-E214 PolarHBondContact N-O 2.88Å; K209-E214 IonicContact NZ-OE2 2.66Å; K209-E214 PolarHBondContact NZ-OE2 3.24Å
210	R	94.1	Very high	94.1	Very high	132 Å²	132	45.7 Å²	45.7	50%	0.498	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.4	-168.1	-65.5	-177.6	63	-170.4	0.8	114.4	S189 E191 W208	S189-R210 PolarHBondContact O-N 3.01Å; E191-R210 HydrophobicContact CB-CG 4.37Å; W208-R210 HydrophobicContact CE3-CG 3.84Å; W208-R210 HydrophobicContact CZ3-CG 4.01Å; W208-R210 PolarHBondContact O-N 3.38Å
211	S	91.3	Very high	94.6	Very high	72 Å²	72	42.6 Å²	42.6	50%	0.503	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-44.2	179.1	50.2	0	0	0	0	113.5	N188 K209	N188-S211 PolarHBondContact OD1-OG 2.92Å; K209-S211 WeakPolarHBondContact CG-OG 3.44Å; K209-S211 PolarHBondContact O-N 2.84Å; K209-S211 VanDerWaalsContact O-N 3.09Å
212	T	93.7	Very high	95.1	Very high	68 Å²	68	42.3 Å²	42.3	42%	0.417	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-10.9	-177.4	53.1	0	0	0	0	113.8	K209 E214	K209-T212 WeakPolarHBondContact CD-OG1 3.25Å; K209-T212 WeakPolarHBondContact CE-OG1 3.39Å; K209-T212 WeakPolarHBondContact CG-OG1 3.4Å; K209-T212 PolarHBondContact NZ-OG1 3.15Å; K209-T212 PolarHBondContact O-N 3.4Å; T212-E214 WeakPolarHBondContact CB-OE2 3.17Å; T212-E214 PolarHBondContact O-N 3.49Å; T212-E214 VanDerWaalsContact OG1-CD 3.25Å; T212-E214 WeakPolarHBondContact OG1-CG 3.39Å; T212-E214 PolarHBondContact OG1-OE2 2.81Å
213	K	93.4	Very high	95.1	Very high	156 Å²	156	45.8 Å²	45.8	68%	0.678	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	14.6	-171.7	-49.3	-178.3	-178.4	178.2	0	114.9	W208 K209	W208-K213 HydrophobicContact CZ2-CB 4.14Å; W208-K213 HydrophobicContact CZ2-CD 4.45Å; W208-K213 HydrophobicContact CZ2-CG 3.94Å; W208-K213 VanDerWaalsContact NE1-CA 3.3Å; W208-K213 PolarHBondContact NE1-O 2.85Å; W208-K213 VanDerWaalsContact NE1-O 3.1Å; K209-K213 VanDerWaalsContact O-CA 3.28Å; K209-K213 WeakPolarHBondContact O-CA 3.28Å; K209-K213 PolarHBondContact O-N 3.09Å
214	E	95.6	Very high	94.9	Very high	81 Å²	81	47.4 Å²	47.4	38%	0.379	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	152.3	177.5	-65.2	164.5	136.6	0	0	111.9	K209 T212	K209-E214 HydrophobicContact CB-CB 4.47Å; K209-E214 PolarHBondContact N-O 2.88Å; K209-E214 IonicContact NZ-OE2 2.66Å; K209-E214 PolarHBondContact NZ-OE2 3.24Å; T212-E214 WeakPolarHBondContact CB-OE2 3.17Å; T212-E214 PolarHBondContact O-N 3.49Å; T212-E214 VanDerWaalsContact OG1-CD 3.25Å; T212-E214 WeakPolarHBondContact OG1-CG 3.39Å; T212-E214 PolarHBondContact OG1-OE2 2.81Å
215	I	97.1	Very high	94.4	Very high	71 Å²	71	50.4 Å²	50.4	36%	0.364	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.5	166.9	-54.4	-64.7	0	0	0	108.3	L193 K206 C207 W208 M270	L193-I215 HydrophobicContact CD1-CD1 3.66Å; K206-I215 HydrophobicContact CG-CG2 3.82Å; C207-I215 WeakPolarHBondContact O-CA 3.43Å; W208-I215 HydrophobicContact CB-CD1 4.34Å; W208-I215 HydrophobicContact CG-CD1 4.48Å; I215-M270 HydrophobicContact CG2-CB 4.09Å; I215-M270 HydrophobicContact CG2-CG 3.89Å; I215-M270 HydrophobicContact CG2-SD 4.3Å
216	V	97.3	Very high	93.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.4	-179.3	-65.1	0	0	0	0	110.6	Y190 C207 I218 Y255 V267 F268	Y190-V216 HydrophobicContact CD1-CG2 3.66Å; Y190-V216 HydrophobicContact CE1-CG2 3.78Å; C207-V216 HydrophobicContact CB-CG2 4Å; C207-V216 PolarHBondContact N-O 3.04Å; C207-V216 WeakPolarHBondContact O-CG2 3.43Å; C207-V216 PolarHBondContact O-N 2.93Å; V216-I218 HydrophobicContact CG2-CD1 4.23Å; V216-I218 HydrophobicContact CG2-CG1 4.04Å; V216-Y255 HydrophobicContact CG1-CD2 4.17Å; V216-Y255 HydrophobicContact CG1-CE2 4.09Å; V216-V267 HydrophobicContact CB-CG1 3.92Å; V216-V267 HydrophobicContact CG1-CG1 4.14Å; V216-V267 HydrophobicContact CG2-CG1 3.95Å; V216-F268 VanDerWaalsContact CB-O 3.32Å; V216-F268 WeakPolarHBondContact CB-O 3.2Å
217	A	97.9	Very high	93	Very high	12 Å²	12	51.9 Å²	51.9	10%	0.099	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133.7	165.4	0	0	0	0	0	109.3	L196 V204 A205 F268 M270	L196-A217 HydrophobicContact CD1-CB 4.44Å; V204-A217 HydrophobicContact CG1-CB 4.12Å; A205-A217 CarbonylContact O-C 2.83Å; A205-A217 WeakPolarHBondContact O-CA 3.46Å; A217-F268 HydrophobicContact CB-CB 4.46Å; A217-F268 PolarHBondContact N-O 2.86Å; A217-F268 VanDerWaalsContact N-O 3.14Å; A217-F268 PolarHBondContact O-N 3.34Å; A217-M270 HydrophobicContact CB-SD 4.28Å
218	I	97.1	Very high	92.3	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	114.3	176.1	-56.2	-170.8	0	0	0	109.4	L183 Y190 V204 A205 C207 V216 I220 C265 L266 V267	L183-I218 HydrophobicContact CD1-CD1 4.35Å; L183-I218 HydrophobicContact CD1-CG2 4.37Å; Y190-I218 HydrophobicContact CD1-CD1 3.75Å; Y190-I218 HydrophobicContact CD2-CD1 4.06Å; Y190-I218 HydrophobicContact CE1-CD1 4.38Å; Y190-I218 HydrophobicContact CG-CD1 3.55Å; V204-I218 WeakPolarHBondContact CA-O 3.46Å; A205-I218 PolarHBondContact N-O 2.94Å; A205-I218 PolarHBondContact O-N 3.22Å; C207-I218 HydrophobicContact CB-CD1 3.76Å; C207-I218 HydrophobicContact CB-CG1 4.06Å; V216-I218 HydrophobicContact CG2-CD1 4.23Å; V216-I218 HydrophobicContact CG2-CG1 4.04Å; I218-I220 HydrophobicContact CG2-CG1 4.14Å; I218-C265 HydrophobicContact CG2-CB 4.01Å; I218-L266 CarbonylContact C-O 3.58Å; I218-L266 WeakPolarHBondContact CA-O 3.24Å; I218-V267 HydrophobicContact CD1-CG2 4.13Å; I218-V267 HydrophobicContact CG1-CG1 4.24Å; I218-V267 HydrophobicContact CG1-CG2 4.18Å
219	K	95.6	Very high	91.6	Very high	19 Å²	19	59 Å²	59	8%	0.083	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	111.1	172.4	-175	178.7	173.5	-168	0	108.5	Q203 V204 L221 E234 C265 L266 F268 D337	Q203-K219 CarbonylContact O-C 3.04Å; Q203-K219 WeakPolarHBondContact O-CA 3.45Å; V204-K219 HydrophobicContact CG2-CB 4.21Å; V204-K219 HydrophobicContact CG2-CG 4.18Å; K219-L221 HydrophobicContact CD-CD2 4.22Å; K219-L221 HydrophobicContact CG-CD2 4.08Å; K219-E234 IonicContact NZ-OE1 3.6Å; K219-E234 PolarHBondContact NZ-OE1 2.87Å; K219-E234 IonicContact NZ-OE2 2.85Å; K219-E234 PolarHBondContact NZ-OE2 2.81Å; K219-C265 WeakPolarHBondContact O-CA 3.45Å; K219-L266 HydrophobicContact CB-CB 4.33Å; K219-L266 HydrophobicContact CD-CD1 4.43Å; K219-L266 PolarHBondContact N-O 2.57Å; K219-L266 PolarHBondContact O-N 3.14Å; K219-F268 HydrophobicContact CB-CD2 4.48Å; K219-F268 HydrophobicContact CB-CE2 3.87Å; K219-F268 HydrophobicContact CD-CE2 4.46Å; K219-D337 IonicContact NZ-OD1 2.64Å; K219-D337 PolarHBondContact NZ-OD1 3.41Å
220	I	94.9	Very high	91	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	111.5	176.8	-50.5	175.8	0	0	0	107.3	Y175 L177 L183 G202 Q203 I218 H263	Y175-I220 HydrophobicContact CD1-CD1 3.95Å; Y175-I220 HydrophobicContact CD1-CG2 4.49Å; Y175-I220 HydrophobicContact CD2-CG2 4.18Å; Y175-I220 HydrophobicContact CE1-CD1 4.26Å; Y175-I220 HydrophobicContact CG-CD1 4.4Å; Y175-I220 HydrophobicContact CG-CG2 3.9Å; L177-I220 HydrophobicContact CD1-CD1 3.91Å; L183-I220 HydrophobicContact CD1-CD1 3.95Å; G202-I220 VanDerWaalsContact CA-O 3.3Å; G202-I220 WeakPolarHBondContact CA-O 3.26Å; Q203-I220 HydrophobicContact CG-CB 4.26Å; Q203-I220 PolarHBondContact N-O 2.85Å; Q203-I220 PolarHBondContact O-N 3.41Å; I218-I220 HydrophobicContact CG2-CG1 4.14Å; I220-H263 HydrophobicContact CG2-CB 3.75Å
221	L	93.2	Very high	90.7	Very high	10 Å²	10	54.4 Å²	54.4	5%	0.052	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	152.5	179.9	-59.3	-174.6	0	0	0	111.5	F201 K219 N223 G231 H263 T264 L266	F201-L221 HydrophobicContact CB-CD2 4.49Å; F201-L221 WeakPolarHBondContact O-CA 3.43Å; K219-L221 HydrophobicContact CD-CD2 4.22Å; K219-L221 HydrophobicContact CG-CD2 4.08Å; L221-N223 PolarHBondContact O-N 3.42Å; L221-G231 VanDerWaalsContact CD1-CA 3.49Å; L221-H263 PolarHBondContact O-ND1 2.79Å; L221-T264 HydrophobicContact CD1-CG2 4.22Å; L221-T264 PolarHBondContact N-O 2.69Å; L221-L266 HydrophobicContact CD1-CD1 4.32Å; L221-L266 HydrophobicContact CG-CD1 4.49Å
222	K	91.6	Very high	90.6	Very high	35 Å²	35	57.6 Å²	57.6	15%	0.152	29%	0.292	C	S	.	.			trans	-66.7	131.9	174.6	-64.7	-169.8	-173.2	-138.6	0	111.2	G173 D174 T200 F201 H224 Y227	G173-K222 CarbonylContact O-C 3.58Å; G173-K222 WeakPolarHBondContact O-CA 3.21Å; G173-K222 WeakPolarHBondContact O-CB 3.46Å; D174-K222 WeakPolarHBondContact OD1-CE 3.38Å; D174-K222 IonicContact OD1-NZ 2.6Å; D174-K222 PolarHBondContact OD1-NZ 3.27Å; D174-K222 IonicContact OD2-NZ 3.77Å; D174-K222 PolarHBondContact OD2-NZ 3.46Å; T200-K222 VanDerWaalsContact O-CE 3.22Å; T200-K222 WeakPolarHBondContact O-CE 3.47Å; F201-K222 PolarHBondContact O-N 3.37Å; K222-H224 PolarHBondContact O-N 3.29Å; K222-Y227 HydrophobicContact CB-CD2 3.81Å; K222-Y227 HydrophobicContact CB-CE2 4.44Å; K222-Y227 HydrophobicContact CD-CD2 4.06Å; K222-Y227 HydrophobicContact CD-CE2 3.85Å; K222-Y227 HydrophobicContact CG-CD2 4.44Å
223	N	89.4	Confident	90.4	Very high	80 Å²	80	56.7 Å²	56.7	43%	0.428	28%	0.284	S	S	.	.			trans	-81.2	72.7	170.8	-179.7	21.7	0	0	0	109.5	G173 L221 H263	G173-N223 VanDerWaalsContact CA-O 3.25Å; G173-N223 WeakPolarHBondContact CA-O 3.38Å; G173-N223 PolarHBondContact O-N 2.88Å; L221-N223 PolarHBondContact O-N 3.42Å; N223-H263 PolarHBondContact N-ND1 3.24Å
224	H	87.8	Confident	90.4	Very high	46 Å²	46	49.4 Å²	49.4	21%	0.213	25%	0.252	C	S	.	.	S	Bend	trans	-141	135.2	177.9	-174.9	-88.5	0	0	0	110	K222 S226 Y227 A228	K222-H224 PolarHBondContact O-N 3.29Å; H224-S226 VanDerWaalsContact C-N 3.26Å; H224-S226 PolarHBondContact CE1-OG 3.27Å; H224-S226 PolarHBondContact ND1-N 3.11Å; H224-S226 PolarHBondContact ND1-OG 3.06Å; H224-S226 PolarHBondContact O-N 3.07Å; H224-S226 VanDerWaalsContact O-N 3.09Å; H224-Y227 HydrophobicContact CB-CD2 3.98Å; H224-Y227 HydrophobicContact CB-CE2 4.42Å; H224-Y227 PolarHBondContact O-N 2.81Å; H224-A228 PolarHBondContact O-N 3.34Å
225	P	84.8	Confident	90.2	Very high	109 Å²	109	47.7 Å²	47.7	71%	0.708	25%	0.247	S	C	*	.	H	α-helix	trans	-53	-36.8	-172.1	-30.3	36.4	0	0	0	115.1	Y227 A228	P225-Y227 PolarHBondContact O-N 2.89Å; P225-A228 PolarHBondContact O-N 2.85Å
226	S	83.1	Confident	90.1	Very high	39 Å²	39	47.9 Å²	47.9	27%	0.273	26%	0.255	S	S	.	.	H	α-helix	trans	-59.4	-28.8	177.5	-47.9	0	0	0	0	114.3	H224	H224-S226 VanDerWaalsContact C-N 3.26Å; H224-S226 PolarHBondContact CE1-OG 3.27Å; H224-S226 PolarHBondContact ND1-N 3.11Å; H224-S226 PolarHBondContact ND1-OG 3.06Å; H224-S226 PolarHBondContact O-N 3.07Å; H224-S226 VanDerWaalsContact O-N 3.09Å
227	Y	82.1	Confident	89.9	Confident	51 Å²	51	48.4 Å²	48.4	20%	0.2	26%	0.258	C	S	.	.	H	α-helix	trans	-101.5	-17.1	-179.2	-53	-58.2	0	0	0	112.8	F201 K222 H224 P225 R229 Q230 G231 I908	F201-Y227 AromaticContact CD1-CD1 4Å; F201-Y227 HydrophobicContact CD1-CD1 4Å; F201-Y227 HydrophobicContact CD1-CE1 4.44Å; K222-Y227 HydrophobicContact CB-CD2 3.81Å; K222-Y227 HydrophobicContact CB-CE2 4.44Å; K222-Y227 HydrophobicContact CD-CD2 4.06Å; K222-Y227 HydrophobicContact CD-CE2 3.85Å; K222-Y227 HydrophobicContact CG-CD2 4.44Å; H224-Y227 HydrophobicContact CB-CD2 3.98Å; H224-Y227 HydrophobicContact CB-CE2 4.42Å; H224-Y227 PolarHBondContact O-N 2.81Å; P225-Y227 PolarHBondContact O-N 2.89Å; Y227-R229 VanDerWaalsContact C-N 3.33Å; Y227-R229 PolarHBondContact O-N 2.87Å; Y227-Q230 PolarHBondContact O-N 3.22Å; Y227-G231 PolarHBondContact O-N 3.32Å; Y227-I908 HydrophobicContact CE1-CD1 3.95Å
228	A	83.6	Confident	89.7	Confident	52 Å²	52	48.2 Å²	48.2	43%	0.43	26%	0.255	S	S	.	.	H	α-helix	trans	-56.4	-43.4	-179.5	0	0	0	0	0	112.9	H224 P225 Q230 G231 Q232	H224-A228 PolarHBondContact O-N 3.34Å; P225-A228 PolarHBondContact O-N 2.85Å; A228-Q230 VanDerWaalsContact C-N 3.34Å; A228-Q230 PolarHBondContact O-N 2.98Å; A228-G231 PolarHBondContact O-N 2.93Å; A228-Q232 WeakPolarHBondContact O-CG 3.43Å; A228-Q232 PolarHBondContact O-N 3.33Å
229	R	84.1	Confident	89.5	Confident	178 Å²	178	52.1 Å²	52.1	67%	0.672	28%	0.282	S	S	*	.	H	α-helix	trans	-62.3	-40.5	174.1	-176.6	-174.9	-67.3	-97.7	2.1	111.9	Y227 Q232 I233	Y227-R229 VanDerWaalsContact C-N 3.33Å; Y227-R229 PolarHBondContact O-N 2.87Å; R229-Q232 PolarHBondContact O-N 3.33Å; R229-I233 HydrophobicContact CG-CD1 4.29Å; R229-I233 WeakPolarHBondContact O-CG1 3.34Å; R229-I233 PolarHBondContact O-N 2.95Å; R229-I233 VanDerWaalsContact O-N 3.12Å
230	Q	83.7	Confident	89.4	Confident	55 Å²	55	55.7 Å²	55.7	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-71	-39.9	-178.9	-161.6	63.2	19.1	0	0	111.4	F201 Y227 A228 Q232 I233 E234 G339	F201-Q230 HydrophobicContact CD1-CG 4.45Å; F201-Q230 HydrophobicContact CE1-CG 4.16Å; Y227-Q230 PolarHBondContact O-N 3.22Å; A228-Q230 VanDerWaalsContact C-N 3.34Å; A228-Q230 PolarHBondContact O-N 2.98Å; Q230-Q232 VanDerWaalsContact C-N 3.32Å; Q230-Q232 PolarHBondContact O-N 2.85Å; Q230-I233 WeakPolarHBondContact O-CB 3.29Å; Q230-I233 PolarHBondContact O-N 3.49Å; Q230-I233 VanDerWaalsContact O-N 3.11Å; Q230-E234 PolarHBondContact O-N 2.91Å; Q230-G339 VanDerWaalsContact CG-O 3.29Å; Q230-G339 WeakPolarHBondContact CG-O 3.32Å; Q230-G339 PolarHBondContact NE2-O 2.8Å
231	G	87.5	Confident	89.4	Confident	7 Å²	7	55.8 Å²	55.8	7%	0.072	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-38.1	172.1	0	0	0	0	0	113.1	L221 Y227 A228 I233 E234 V235	L221-G231 VanDerWaalsContact CD1-CA 3.49Å; Y227-G231 PolarHBondContact O-N 3.32Å; A228-G231 PolarHBondContact O-N 2.93Å; G231-I233 VanDerWaalsContact C-N 3.34Å; G231-E234 PolarHBondContact O-N 3.41Å; G231-V235 WeakPolarHBondContact O-CB 3.38Å; G231-V235 VanDerWaalsContact O-CG2 3.26Å; G231-V235 WeakPolarHBondContact O-CG2 3.33Å; G231-V235 PolarHBondContact O-N 3.42Å
232	Q	90.1	Very high	89.3	Confident	140 Å²	140	58.9 Å²	58.9	65%	0.654	32%	0.319	S	S	*	.	H	α-helix	trans	-64.4	-36.6	172.5	-72.8	172.2	-8.7	0	0	112.6	A228 R229 Q230 S236	A228-Q232 WeakPolarHBondContact O-CG 3.43Å; A228-Q232 PolarHBondContact O-N 3.33Å; R229-Q232 PolarHBondContact O-N 3.33Å; Q230-Q232 VanDerWaalsContact C-N 3.32Å; Q230-Q232 PolarHBondContact O-N 2.85Å; Q232-S236 VanDerWaalsContact O-CB 3.32Å; Q232-S236 WeakPolarHBondContact O-CB 3.45Å; Q232-S236 PolarHBondContact O-N 3.14Å
233	I	89.2	Confident	89.4	Confident	48 Å²	48	61.7 Å²	61.7	25%	0.246	34%	0.343	C	S	.	.	H	α-helix	trans	-67.8	-46.5	174.6	-67.5	164.3	0	0	0	110.4	R229 Q230 G231 V235 S236 I237 A341	R229-I233 HydrophobicContact CG-CD1 4.29Å; R229-I233 WeakPolarHBondContact O-CG1 3.34Å; R229-I233 PolarHBondContact O-N 2.95Å; R229-I233 VanDerWaalsContact O-N 3.12Å; Q230-I233 WeakPolarHBondContact O-CB 3.29Å; Q230-I233 PolarHBondContact O-N 3.49Å; Q230-I233 VanDerWaalsContact O-N 3.11Å; G231-I233 VanDerWaalsContact C-N 3.34Å; I233-V235 PolarHBondContact O-N 2.86Å; I233-S236 WeakPolarHBondContact O-CB 3.44Å; I233-S236 PolarHBondContact O-N 2.56Å; I233-I237 HydrophobicContact CG2-CD1 3.84Å; I233-I237 WeakPolarHBondContact O-CG1 3.39Å; I233-I237 PolarHBondContact O-N 3.31Å; I233-A341 WeakPolarHBondContact CG2-O 3.41Å
234	E	91.8	Very high	89.6	Confident	3 Å²	3	60.5 Å²	60.5	1%	0.014	33%	0.334	C	S	.	.	H	α-helix	trans	-59.4	-47.8	177	-174.9	174.3	176.5	0	0	111.3	K219 Q230 G231 S236 I237 L238 L266 G339	K219-E234 IonicContact NZ-OE1 3.6Å; K219-E234 PolarHBondContact NZ-OE1 2.87Å; K219-E234 IonicContact NZ-OE2 2.85Å; K219-E234 PolarHBondContact NZ-OE2 2.81Å; Q230-E234 PolarHBondContact O-N 2.91Å; G231-E234 PolarHBondContact O-N 3.41Å; E234-S236 VanDerWaalsContact C-N 3.33Å; E234-S236 PolarHBondContact O-N 3.41Å; E234-I237 PolarHBondContact O-N 2.94Å; E234-I237 VanDerWaalsContact O-N 3.14Å; E234-L238 HydrophobicContact CG-CD1 3.88Å; E234-L238 HydrophobicContact CG-CG 4.31Å; E234-L238 WeakPolarHBondContact O-CB 3.2Å; E234-L238 VanDerWaalsContact O-CG 3.32Å; E234-L238 WeakPolarHBondContact O-CG 3.36Å; E234-L238 PolarHBondContact O-N 2.85Å; E234-L266 HydrophobicContact CG-CD1 4.01Å; E234-L266 WeakPolarHBondContact OE1-CD1 3.31Å; E234-G339 WeakPolarHBondContact OE2-CA 3.42Å
235	V	92.8	Very high	89.9	Confident	45 Å²	45	62 Å²	62	27%	0.273	34%	0.344	S	S	.	.	H	α-helix	trans	-57.6	-44.4	174	169.6	0	0	0	0	111.5	G231 I233 I237 L238 S239 T264 L266	G231-V235 WeakPolarHBondContact O-CB 3.38Å; G231-V235 VanDerWaalsContact O-CG2 3.26Å; G231-V235 WeakPolarHBondContact O-CG2 3.33Å; G231-V235 PolarHBondContact O-N 3.42Å; I233-V235 PolarHBondContact O-N 2.86Å; V235-I237 VanDerWaalsContact C-N 3.28Å; V235-I237 PolarHBondContact O-N 3Å; V235-L238 PolarHBondContact O-N 2.74Å; V235-S239 VanDerWaalsContact O-CB 3.24Å; V235-S239 WeakPolarHBondContact O-CB 3.36Å; V235-S239 PolarHBondContact O-N 2.82Å; V235-T264 HydrophobicContact CG2-CG2 4.17Å; V235-L266 HydrophobicContact CG2-CD2 3.64Å
236	S	93.6	Very high	90.4	Very high	75 Å²	75	57.2 Å²	57.2	52%	0.524	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-29.9	178.1	-179.8	0	0	0	0	113.3	Q232 I233 E234	Q232-S236 VanDerWaalsContact O-CB 3.32Å; Q232-S236 WeakPolarHBondContact O-CB 3.45Å; Q232-S236 PolarHBondContact O-N 3.14Å; I233-S236 WeakPolarHBondContact O-CB 3.44Å; I233-S236 PolarHBondContact O-N 2.56Å; E234-S236 VanDerWaalsContact C-N 3.33Å; E234-S236 PolarHBondContact O-N 3.41Å
237	I	94.5	Very high	90.9	Very high	11 Å²	11	58.2 Å²	58.2	6%	0.056	32%	0.316	C	S	.	.	H	α-helix	trans	-81.4	-45.7	177.9	-70.6	173	0	0	0	110.2	I233 E234 V235 S239 R240 L241 L311 F338 A341	I233-I237 HydrophobicContact CG2-CD1 3.84Å; I233-I237 WeakPolarHBondContact O-CG1 3.39Å; I233-I237 PolarHBondContact O-N 3.31Å; E234-I237 PolarHBondContact O-N 2.94Å; E234-I237 VanDerWaalsContact O-N 3.14Å; V235-I237 VanDerWaalsContact C-N 3.28Å; V235-I237 PolarHBondContact O-N 3Å; I237-S239 VanDerWaalsContact C-N 3.26Å; I237-S239 PolarHBondContact O-N 2.88Å; I237-R240 CarbonylContact O-C 3.44Å; I237-R240 WeakPolarHBondContact O-CA 3.22Å; I237-R240 WeakPolarHBondContact O-CB 3.15Å; I237-R240 PolarHBondContact O-N 2.89Å; I237-L241 HydrophobicContact CG2-CD1 4.04Å; I237-L241 HydrophobicContact CG2-CG 4.49Å; I237-L241 WeakPolarHBondContact O-CG 2.98Å; I237-L241 PolarHBondContact O-N 2.82Å; I237-L311 HydrophobicContact CD1-CD2 4.43Å; I237-L311 HydrophobicContact CG1-CD2 4.16Å; I237-L311 HydrophobicContact CG2-CD1 4.22Å; I237-L311 HydrophobicContact CG2-CD2 4.47Å; I237-F338 HydrophobicContact CG2-CB 4.18Å; I237-F338 HydrophobicContact CG2-CD1 4.13Å; I237-F338 HydrophobicContact CG2-CG 4.33Å; I237-A341 HydrophobicContact CD1-CB 3.67Å; I237-A341 WeakPolarHBondContact CD1-O 3.2Å; I237-A341 HydrophobicContact CG2-CB 4.36Å
238	L	93.9	Very high	91.5	Very high	8 Å²	8	59.6 Å²	59.6	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-36.9	174.7	-68	174.6	0	0	0	111.8	E234 V235 R240 L241 S242 L266 F268 F338	E234-L238 HydrophobicContact CG-CD1 3.88Å; E234-L238 HydrophobicContact CG-CG 4.31Å; E234-L238 WeakPolarHBondContact O-CB 3.2Å; E234-L238 VanDerWaalsContact O-CG 3.32Å; E234-L238 WeakPolarHBondContact O-CG 3.36Å; E234-L238 PolarHBondContact O-N 2.85Å; V235-L238 PolarHBondContact O-N 2.74Å; L238-R240 PolarHBondContact O-N 2.98Å; L238-L241 PolarHBondContact O-N 3.27Å; L238-S242 WeakPolarHBondContact O-CB 3.44Å; L238-S242 PolarHBondContact O-N 2.81Å; L238-S242 PolarHBondContact O-OG 3.1Å; L238-L266 HydrophobicContact CD1-CD1 3.92Å; L238-L266 HydrophobicContact CD1-CD2 4.45Å; L238-F268 HydrophobicContact CD1-CE1 3.83Å; L238-F268 HydrophobicContact CD1-CZ 3.67Å; L238-F268 HydrophobicContact CD2-CE1 3.87Å; L238-F268 HydrophobicContact CD2-CZ 4.42Å; L238-F338 HydrophobicContact CD2-CB 4.38Å; L238-F338 HydrophobicContact CD2-CD2 3.83Å; L238-F338 HydrophobicContact CD2-CG 4.39Å
239	S	92.8	Very high	92.1	Very high	82 Å²	82	59.6 Å²	59.6	57%	0.573	31%	0.313	S	S	*	.	H	α-helix	trans	-68.3	-15.6	173.3	-173.6	0	0	0	0	114.3	V235 I237 S242	V235-S239 VanDerWaalsContact O-CB 3.24Å; V235-S239 WeakPolarHBondContact O-CB 3.36Å; V235-S239 PolarHBondContact O-N 2.82Å; I237-S239 VanDerWaalsContact C-N 3.26Å; I237-S239 PolarHBondContact O-N 2.88Å; S239-S242 WeakPolarHBondContact CA-OG 3.3Å; S239-S242 PolarHBondContact O-OG 2.94Å
240	R	92.8	Very high	92.7	Very high	94 Å²	94	51.7 Å²	51.7	36%	0.355	28%	0.284	S	S	.	.	H	α-helix	trans	-95.4	-22.4	172.6	-171.3	173.8	-178.5	-165.8	-5.3	112.3	I237 L238 S243 L309 H343	I237-R240 CarbonylContact O-C 3.44Å; I237-R240 WeakPolarHBondContact O-CA 3.22Å; I237-R240 WeakPolarHBondContact O-CB 3.15Å; I237-R240 PolarHBondContact O-N 2.89Å; L238-R240 PolarHBondContact O-N 2.98Å; R240-S243 PolarHBondContact O-OG 2.87Å; R240-S243 VanDerWaalsContact O-OG 3.07Å; R240-L309 PolarHBondContact NH1-O 2.78Å; R240-L309 PolarHBondContact NH2-O 2.9Å; R240-H343 PolarHBondContact NH1-CD2 3.01Å; R240-H343 VanDerWaalsContact NH1-CD2 3.27Å; R240-H343 PolarHBondContact NH1-NE2 3.44Å
241	L	94.3	Very high	93.3	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-85.1	-24.1	172.5	-64.2	173.8	0	0	0	112.3	I237 L238 S243 E244 F251 L306 L309 L311 F338	I237-L241 HydrophobicContact CG2-CD1 4.04Å; I237-L241 HydrophobicContact CG2-CG 4.49Å; I237-L241 WeakPolarHBondContact O-CG 2.98Å; I237-L241 PolarHBondContact O-N 2.82Å; L238-L241 PolarHBondContact O-N 3.27Å; L241-S243 PolarHBondContact O-N 2.78Å; L241-E244 WeakPolarHBondContact O-CB 3.48Å; L241-E244 PolarHBondContact O-N 2.73Å; L241-E244 VanDerWaalsContact O-N 3.11Å; L241-F251 HydrophobicContact CB-CD2 4.37Å; L241-F251 HydrophobicContact CB-CE2 3.89Å; L241-F251 HydrophobicContact CB-CZ 4.33Å; L241-F251 HydrophobicContact CD2-CE1 4.16Å; L241-F251 HydrophobicContact CD2-CE2 4.31Å; L241-F251 HydrophobicContact CD2-CZ 4.06Å; L241-L306 HydrophobicContact CD1-CD2 4.46Å; L241-L306 HydrophobicContact CD2-CD2 3.77Å; L241-L309 HydrophobicContact CD2-CD1 3.84Å; L241-L311 HydrophobicContact CD2-CD1 4.12Å; L241-F338 HydrophobicContact CD1-CD1 3.83Å; L241-F338 HydrophobicContact CD1-CD2 3.89Å; L241-F338 HydrophobicContact CD1-CE1 3.58Å; L241-F338 HydrophobicContact CD1-CE2 3.65Å; L241-F338 HydrophobicContact CD1-CG 3.98Å; L241-F338 HydrophobicContact CD1-CZ 3.5Å
242	S	92.4	Very high	93.8	Very high	76 Å²	76	49.1 Å²	49.1	53%	0.531	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-15.2	177.4	59.3	0	0	0	0	114.5	L238 S239 E244	L238-S242 WeakPolarHBondContact O-CB 3.44Å; L238-S242 PolarHBondContact O-N 2.81Å; L238-S242 PolarHBondContact O-OG 3.1Å; S239-S242 WeakPolarHBondContact CA-OG 3.3Å; S239-S242 PolarHBondContact O-OG 2.94Å; S242-E244 VanDerWaalsContact C-N 3.25Å
243	S	92.1	Very high	94.1	Very high	94 Å²	94	48 Å²	48	66%	0.657	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	5.8	170.1	54.2	0	0	0	0	113.4	R240 L241	R240-S243 PolarHBondContact O-OG 2.87Å; R240-S243 VanDerWaalsContact O-OG 3.07Å; L241-S243 PolarHBondContact O-N 2.78Å
244	E	95.1	Very high	94.4	Very high	55 Å²	55	46.9 Å²	46.9	26%	0.257	26%	0.257	S	S	.	.	S	Bend	trans	-128.5	154.6	-170.2	-65.7	-75.1	-162.6	0	0	111.2	L241 S242 A246 F251 K305 L309	L241-E244 WeakPolarHBondContact O-CB 3.48Å; L241-E244 PolarHBondContact O-N 2.73Å; L241-E244 VanDerWaalsContact O-N 3.11Å; S242-E244 VanDerWaalsContact C-N 3.25Å; E244-A246 PolarHBondContact O-N 2.75Å; E244-F251 HydrophobicContact CB-CZ 3.85Å; E244-K305 WeakPolarHBondContact OE1-CE 3.29Å; E244-K305 IonicContact OE1-NZ 2.69Å; E244-K305 PolarHBondContact OE1-NZ 3.04Å; E244-K305 WeakPolarHBondContact OE2-CE 3.45Å; E244-K305 IonicContact OE2-NZ 2.75Å; E244-K305 PolarHBondContact OE2-NZ 3.34Å; E244-L309 HydrophobicContact CG-CD1 4.49Å
245	N	94.6	Very high	94.4	Very high	77 Å²	77	51.2 Å²	51.2	41%	0.412	27%	0.274	S	S	.	.			trans	-78.2	87.2	-173.5	-170.5	2.9	0	0	0	112.6	D247 E248 Y249	N245-D247 PolarHBondContact O-N 3.49Å; N245-D247 VanDerWaalsContact O-N 3.15Å; N245-D247 PolarHBondContact OD1-N 3.03Å; N245-E248 HydrophobicContact CB-CB 3.99Å; N245-E248 WeakPolarHBondContact ND2-CB 3.4Å; N245-E248 PolarHBondContact ND2-OE2 2.78Å; N245-E248 PolarHBondContact O-N 3.4Å; N245-Y249 HydrophobicContact CB-CD2 4.28Å; N245-Y249 HydrophobicContact CB-CE2 4.29Å; N245-Y249 VanDerWaalsContact O-CD2 3.31Å; N245-Y249 WeakPolarHBondContact O-CD2 3.43Å; N245-Y249 PolarHBondContact O-N 3.44Å
246	A	94.7	Very high	94.4	Very high	8 Å²	8	51.1 Å²	51.1	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-51.7	-34	179.9	0	0	0	0	0	114.6	E244 N250 F251 R253	E244-A246 PolarHBondContact O-N 2.75Å; A246-N250 PolarHBondContact O-N 2.76Å; A246-F251 HydrophobicContact CB-CD2 3.9Å; A246-F251 HydrophobicContact CB-CE2 3.69Å; A246-F251 WeakPolarHBondContact CB-O 3.31Å; A246-F251 PolarHBondContact O-N 3.1Å; A246-R253 HydrophobicContact CB-CB 3.9Å; A246-R253 HydrophobicContact CB-CG 4.37Å
247	D	93.4	Very high	94.5	Very high	60 Å²	60	50.7 Å²	50.7	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-79	-21.3	-179.7	-83.5	-61.1	0	0	0	114.5	N245 R332 K334	N245-D247 PolarHBondContact O-N 3.49Å; N245-D247 VanDerWaalsContact O-N 3.15Å; N245-D247 PolarHBondContact OD1-N 3.03Å; D247-R332 PolarHBondContact O-NH2 2.93Å; D247-R332 IonicContact OD1-CZ 3.44Å; D247-R332 IonicContact OD1-NH2 2.87Å; D247-R332 PolarHBondContact OD1-NH2 2.8Å; D247-K334 WeakPolarHBondContact OD1-CE 3.3Å; D247-K334 IonicContact OD1-NZ 3.56Å; D247-K334 PolarHBondContact OD1-NZ 3.11Å; D247-K334 IonicContact OD2-NZ 3.85Å
248	E	93.6	Very high	94.5	Very high	80 Å²	80	50.9 Å²	50.9	37%	0.374	27%	0.267	S	S	.	.	H	α-helix	trans	-92.9	-34.9	176.2	175.2	170.3	-155.7	0	0	111.8	N245 N250	N245-E248 HydrophobicContact CB-CB 3.99Å; N245-E248 WeakPolarHBondContact ND2-CB 3.4Å; N245-E248 PolarHBondContact ND2-OE2 2.78Å; N245-E248 PolarHBondContact O-N 3.4Å; E248-N250 PolarHBondContact O-ND2 3.16Å
249	Y	96.5	Very high	94.4	Very high	52 Å²	52	57.5 Å²	57.5	20%	0.204	30%	0.298	C	S	.	.	H	α-helix	trans	-96.6	2.5	-179.4	-60.9	-55.9	0	0	0	114.4	N245 F251 T301 A302 K305	N245-Y249 HydrophobicContact CB-CD2 4.28Å; N245-Y249 HydrophobicContact CB-CE2 4.29Å; N245-Y249 VanDerWaalsContact O-CD2 3.31Å; N245-Y249 WeakPolarHBondContact O-CD2 3.43Å; N245-Y249 PolarHBondContact O-N 3.44Å; Y249-F251 HydrophobicContact CD2-CE1 4.26Å; Y249-F251 HydrophobicContact CG-CE1 4.22Å; Y249-F251 PolarHBondContact O-N 3.1Å; Y249-T301 HydrophobicContact CD1-CG2 4.27Å; Y249-A302 WeakPolarHBondContact O-CA 3.41Å; Y249-A302 WeakPolarHBondContact O-CB 3.47Å; Y249-A302 PolarHBondContact O-N 2.73Å; Y249-K305 HydrophobicContact CD1-CB 3.83Å; Y249-K305 HydrophobicContact CD1-CD 3.98Å; Y249-K305 HydrophobicContact CD1-CG 3.92Å; Y249-K305 HydrophobicContact CD2-CD 3.87Å; Y249-K305 HydrophobicContact CD2-CG 3.79Å; Y249-K305 HydrophobicContact CE1-CB 4.45Å; Y249-K305 HydrophobicContact CE1-CD 3.85Å; Y249-K305 HydrophobicContact CE1-CG 4.32Å; Y249-K305 HydrophobicContact CE2-CD 3.7Å; Y249-K305 HydrophobicContact CE2-CG 4.17Å; Y249-K305 HydrophobicContact CG-CB 3.88Å; Y249-K305 HydrophobicContact CG-CD 4Å; Y249-K305 HydrophobicContact CG-CG 3.65Å
250	N	97.6	Very high	94.4	Very high	12 Å²	12	54.7 Å²	54.7	6%	0.064	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	41.9	170.6	-46.7	-67.1	0	0	0	114.7	A246 E248 Q298 K334 V335	A246-N250 PolarHBondContact O-N 2.76Å; E248-N250 PolarHBondContact O-ND2 3.16Å; N250-Q298 HydrophobicContact CB-CB 4.06Å; N250-Q298 PolarHBondContact ND2-O 2.95Å; N250-K334 CarbonylContact O-C 3.58Å; N250-K334 WeakPolarHBondContact O-CA 3.07Å; N250-V335 PolarHBondContact O-N 3.13Å
251	F	96.8	Very high	94.4	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.009	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-119.1	159	165.5	53.5	-106.7	0	0	0	110.4	L241 E244 A246 Y249 R253 K305 F338	L241-F251 HydrophobicContact CB-CD2 4.37Å; L241-F251 HydrophobicContact CB-CE2 3.89Å; L241-F251 HydrophobicContact CB-CZ 4.33Å; L241-F251 HydrophobicContact CD2-CE1 4.16Å; L241-F251 HydrophobicContact CD2-CE2 4.31Å; L241-F251 HydrophobicContact CD2-CZ 4.06Å; E244-F251 HydrophobicContact CB-CZ 3.85Å; A246-F251 HydrophobicContact CB-CD2 3.9Å; A246-F251 HydrophobicContact CB-CE2 3.69Å; A246-F251 WeakPolarHBondContact CB-O 3.31Å; A246-F251 PolarHBondContact O-N 3.1Å; Y249-F251 HydrophobicContact CD2-CE1 4.26Å; Y249-F251 HydrophobicContact CG-CE1 4.22Å; Y249-F251 PolarHBondContact O-N 3.1Å; F251-R253 PolarHBondContact O-N 2.92Å; F251-K305 HydrophobicContact CE1-CG 4.12Å; F251-F338 HydrophobicContact CB-CE2 4.2Å; F251-F338 HydrophobicContact CB-CZ 3.9Å
252	V	97.1	Very high	94.2	Very high	7 Å²	7	61.3 Å²	61.3	4%	0.042	31%	0.313	C	S	.	.			trans	-65.5	132	-177.3	68.5	0	0	0	0	112.2	S254 F268 E269 L271 V335 I336 F338	V252-S254 PolarHBondContact O-N 3.04Å; V252-F268 HydrophobicContact CG1-CD1 3.96Å; V252-F268 HydrophobicContact CG1-CE1 4.09Å; V252-F268 HydrophobicContact CG2-CB 3.99Å; V252-F268 HydrophobicContact CG2-CD1 3.91Å; V252-F268 HydrophobicContact CG2-CG 4.26Å; V252-E269 HydrophobicContact CG2-CG 3.81Å; V252-L271 HydrophobicContact CG2-CD1 4.15Å; V252-V335 PolarHBondContact N-O 3.39Å; V252-I336 HydrophobicContact CB-CG2 3.89Å; V252-I336 HydrophobicContact CG1-CB 4.36Å; V252-I336 HydrophobicContact CG1-CG2 4.18Å; V252-I336 HydrophobicContact CG2-CG2 4.26Å; V252-F338 HydrophobicContact CG1-CE2 4.25Å
253	R	96.1	Very high	94.2	Very high	117 Å²	117	58.5 Å²	58.5	44%	0.442	29%	0.291	S	S	.	.			trans	-77.4	113.8	175.8	-174.1	175	-175.3	163.8	0.1	110.2	A246 F251 Y255 F268 E269	A246-R253 HydrophobicContact CB-CB 3.9Å; A246-R253 HydrophobicContact CB-CG 4.37Å; F251-R253 PolarHBondContact O-N 2.92Å; R253-Y255 HydrophobicContact CG-CD1 4.4Å; R253-Y255 HydrophobicContact CG-CE1 4.13Å; R253-F268 VanDerWaalsContact O-CA 3.31Å; R253-F268 WeakPolarHBondContact O-CA 2.99Å; R253-E269 HydrophobicContact CB-CG 4.3Å; R253-E269 WeakPolarHBondContact CB-OE1 3.49Å; R253-E269 PolarHBondContact N-OE1 3.42Å; R253-E269 PolarHBondContact O-N 2.84Å; R253-E269 VanDerWaalsContact O-N 3.12Å
254	S	95.3	Very high	94.2	Very high	23 Å²	23	55.8 Å²	55.8	16%	0.161	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	140.4	160	48.2	0	0	0	0	110.1	V252 V267	V252-S254 PolarHBondContact O-N 3.04Å; S254-V267 CarbonylContact C-O 3.52Å; S254-V267 WeakPolarHBondContact CA-O 3.43Å
255	Y	93.4	Very high	94.3	Very high	94 Å²	94	53.2 Å²	53.2	37%	0.369	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-51	174.9	-70.3	-55.2	0	0	0	111.9	V216 R253 V267 E269	V216-Y255 HydrophobicContact CG1-CD2 4.17Å; V216-Y255 HydrophobicContact CG1-CE2 4.09Å; R253-Y255 HydrophobicContact CG-CD1 4.4Å; R253-Y255 HydrophobicContact CG-CE1 4.13Å; Y255-V267 HydrophobicContact CD2-CG1 4.2Å; Y255-V267 PolarHBondContact N-O 3.14Å; Y255-E269 HydrophobicContact CE2-CB 4.16Å
256	E	92.6	Very high	94.3	Very high	44 Å²	44	49.7 Å²	49.7	21%	0.206	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	162.6	178.5	55.5	176.7	-114	0	0	111.4	S185 T187 N188 Y190 V267	S185-E256 WeakPolarHBondContact CB-OE1 3.23Å; S185-E256 PolarHBondContact OG-OE1 3.01Å; T187-E256 PolarHBondContact OG1-OE2 3.48Å; T187-E256 VanDerWaalsContact OG1-OE2 3.12Å; N188-E256 PolarHBondContact ND2-OE2 3.48Å; Y190-E256 PolarHBondContact OH-OE1 3.2Å; Y190-E256 PolarHBondContact OH-OE2 2.83Å; E256-V267 HydrophobicContact CG-CB 4.05Å; E256-V267 HydrophobicContact CG-CG2 3.78Å; E256-V267 PolarHBondContact O-N 3.25Å
257	C	94.1	Very high	94.4	Very high	65 Å²	65	49.4 Å²	49.4	44%	0.439	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.1	172.5	169.1	0	0	0	0	108.1	C265 L266	C257-C265 WeakPolarHBondContact CA-O 3.44Å; C257-L266 HydrophobicContact CB-CD2 3.9Å
258	F	94.6	Very high	94.6	Very high	16 Å²	16	47.4 Å²	47.4	7%	0.07	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	170.5	178.7	67.8	-82.8	0	0	0	111.3	L183 C184 Y190 H260 C265 V267	L183-F258 HydrophobicContact CB-CE2 4.34Å; L183-F258 HydrophobicContact CB-CZ 4.11Å; C184-F258 WeakPolarHBondContact O-CD2 3.5Å; C184-F258 VanDerWaalsContact O-CE2 3.28Å; C184-F258 WeakPolarHBondContact O-CE2 3.49Å; Y190-F258 HydrophobicContact CD2-CE1 4.14Å; Y190-F258 HydrophobicContact CD2-CZ 4.09Å; Y190-F258 HydrophobicContact CE2-CE1 4.03Å; Y190-F258 HydrophobicContact CE2-CZ 4.42Å; F258-H260 HydrophobicContact CD2-CB 4.32Å; F258-H260 HydrophobicContact CE2-CB 3.92Å; F258-C265 HydrophobicContact CD1-CB 3.92Å; F258-C265 HydrophobicContact CD2-CB 4.14Å; F258-C265 HydrophobicContact CE1-CB 3.64Å; F258-C265 HydrophobicContact CE2-CB 3.89Å; F258-C265 HydrophobicContact CG-CB 4.16Å; F258-C265 HydrophobicContact CZ-CB 3.62Å; F258-C265 PolarHBondContact N-O 2.84Å; F258-C265 PolarHBondContact O-N 2.69Å; F258-V267 HydrophobicContact CD1-CG2 4.03Å; F258-V267 HydrophobicContact CE1-CG2 3.57Å
259	Q	93.2	Very high	94.7	Very high	146 Å²	146	44.7 Å²	44.7	68%	0.682	21%	0.213	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.8	170.7	-68.8	-173.5	11.8	0	0	110.6	H263	Q259-H263 CarbonylContact C-O 3.53Å; Q259-H263 VanDerWaalsContact CA-O 3.29Å; Q259-H263 WeakPolarHBondContact CA-O 3.34Å
260	H	92.8	Very high	94.7	Very high	24 Å²	24	44.4 Å²	44.4	11%	0.111	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	120.4	174.1	-166.9	78.5	0	0	0	110	Y175 C184 F258 N262 H263	Y175-H260 AromaticContact CE2-CD2 3.99Å; Y175-H260 PolarHBondContact OH-CD2 2.96Å; C184-H260 PolarHBondContact N-ND1 2.66Å; F258-H260 HydrophobicContact CD2-CB 4.32Å; F258-H260 HydrophobicContact CE2-CB 3.92Å; H260-N262 PolarHBondContact O-N 3.47Å; H260-H263 PolarHBondContact N-O 3.24Å; H260-H263 WeakPolarHBondContact O-CB 3.31Å; H260-H263 PolarHBondContact O-N 2.77Å
261	K	91.6	Very high	94.7	Very high	115 Å²	115	44.3 Å²	44.3	50%	0.5	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	41.9	-176.9	-55	178	-165.5	158.9	0	113.7	Y175 E181 H263	Y175-K261 HydrophobicContact CE2-CB 4.35Å; Y175-K261 HydrophobicContact CE2-CD 4.01Å; Y175-K261 PolarHBondContact OH-NZ 3.05Å; E181-K261 IonicContact OE1-NZ 3.84Å; E181-K261 PolarHBondContact OE1-NZ 3.12Å; E181-K261 IonicContact OE2-NZ 3.35Å; K261-H263 VanDerWaalsContact C-N 3.29Å; K261-H263 PolarHBondContact O-CD2 2.98Å; K261-H263 PolarHBondContact O-N 2.73Å
262	N	89.9	Confident	94.6	Very high	121 Å²	121	50.5 Å²	50.5	65%	0.647	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.6	8.7	-176.3	-49.2	-19.6	0	0	0	116.2	H260	H260-N262 PolarHBondContact O-N 3.47Å
263	H	93	Very high	94.5	Very high	17 Å²	17	51.3 Å²	51.3	8%	0.079	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	142.2	168.4	-65.4	-107.4	0	0	0	110.8	G173 Y175 I220 L221 N223 Q259 H260 K261	G173-H263 PolarHBondContact O-CE1 2.97Å; G173-H263 VanDerWaalsContact O-CE1 3.22Å; Y175-H263 HydrophobicContact CD2-CB 4.39Å; Y175-H263 AromaticContact CD2-CD2 3.58Å; Y175-H263 AromaticContact CD2-CG 3.85Å; Y175-H263 AromaticContact CD2-NE2 3.82Å; I220-H263 HydrophobicContact CG2-CB 3.75Å; L221-H263 PolarHBondContact O-ND1 2.79Å; N223-H263 PolarHBondContact N-ND1 3.24Å; Q259-H263 CarbonylContact C-O 3.53Å; Q259-H263 VanDerWaalsContact CA-O 3.29Å; Q259-H263 WeakPolarHBondContact CA-O 3.34Å; H260-H263 PolarHBondContact N-O 3.24Å; H260-H263 WeakPolarHBondContact O-CB 3.31Å; H260-H263 PolarHBondContact O-N 2.77Å; K261-H263 VanDerWaalsContact C-N 3.29Å; K261-H263 PolarHBondContact O-CD2 2.98Å; K261-H263 PolarHBondContact O-N 2.73Å
264	T	93.6	Very high	94.6	Very high	37 Å²	37	47 Å²	47	23%	0.227	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.3	170.8	-58.9	0	0	0	0	109.7	L221 V235 L266	L221-T264 HydrophobicContact CD1-CG2 4.22Å; L221-T264 PolarHBondContact N-O 2.69Å; V235-T264 HydrophobicContact CG2-CG2 4.17Å; T264-L266 HydrophobicContact CG2-CD2 4.01Å
265	C	95.4	Very high	94.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122.6	179.6	-65.3	0	0	0	0	109.9	I218 K219 C257 F258	I218-C265 HydrophobicContact CG2-CB 4.01Å; K219-C265 WeakPolarHBondContact O-CA 3.45Å; C257-C265 WeakPolarHBondContact CA-O 3.44Å; F258-C265 HydrophobicContact CD1-CB 3.92Å; F258-C265 HydrophobicContact CD2-CB 4.14Å; F258-C265 HydrophobicContact CE1-CB 3.64Å; F258-C265 HydrophobicContact CE2-CB 3.89Å; F258-C265 HydrophobicContact CG-CB 4.16Å; F258-C265 HydrophobicContact CZ-CB 3.62Å; F258-C265 PolarHBondContact N-O 2.84Å; F258-C265 PolarHBondContact O-N 2.69Å
266	L	95.5	Very high	94.9	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.7	178.7	-51.8	175.2	0	0	0	108.9	I218 K219 L221 E234 V235 L238 C257 T264 F268	I218-L266 CarbonylContact C-O 3.58Å; I218-L266 WeakPolarHBondContact CA-O 3.24Å; K219-L266 HydrophobicContact CB-CB 4.33Å; K219-L266 HydrophobicContact CD-CD1 4.43Å; K219-L266 PolarHBondContact N-O 2.57Å; K219-L266 PolarHBondContact O-N 3.14Å; L221-L266 HydrophobicContact CD1-CD1 4.32Å; L221-L266 HydrophobicContact CG-CD1 4.49Å; E234-L266 HydrophobicContact CG-CD1 4.01Å; E234-L266 WeakPolarHBondContact OE1-CD1 3.31Å; V235-L266 HydrophobicContact CG2-CD2 3.64Å; L238-L266 HydrophobicContact CD1-CD1 3.92Å; L238-L266 HydrophobicContact CD1-CD2 4.45Å; C257-L266 HydrophobicContact CB-CD2 3.9Å; T264-L266 HydrophobicContact CG2-CD2 4.01Å; L266-F268 HydrophobicContact CB-CD2 4.45Å; L266-F268 HydrophobicContact CB-CE2 3.58Å; L266-F268 HydrophobicContact CB-CZ 3.85Å; L266-F268 HydrophobicContact CD1-CZ 4.35Å; L266-F268 WeakPolarHBondContact O-CD2 3.23Å
267	V	96.3	Very high	95.1	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.6	-177.9	-169.6	0	0	0	0	110.1	Y190 V216 I218 S254 Y255 E256 F258	Y190-V267 HydrophobicContact CE1-CG1 3.9Å; Y190-V267 HydrophobicContact CE2-CG2 4.21Å; V216-V267 HydrophobicContact CB-CG1 3.92Å; V216-V267 HydrophobicContact CG1-CG1 4.14Å; V216-V267 HydrophobicContact CG2-CG1 3.95Å; I218-V267 HydrophobicContact CD1-CG2 4.13Å; I218-V267 HydrophobicContact CG1-CG1 4.24Å; I218-V267 HydrophobicContact CG1-CG2 4.18Å; S254-V267 CarbonylContact C-O 3.52Å; S254-V267 WeakPolarHBondContact CA-O 3.43Å; Y255-V267 HydrophobicContact CD2-CG1 4.2Å; Y255-V267 PolarHBondContact N-O 3.14Å; E256-V267 HydrophobicContact CG-CB 4.05Å; E256-V267 HydrophobicContact CG-CG2 3.78Å; E256-V267 PolarHBondContact O-N 3.25Å; F258-V267 HydrophobicContact CD1-CG2 4.03Å; F258-V267 HydrophobicContact CE1-CG2 3.57Å
268	F	97.2	Very high	95.3	Very high	19 Å²	19	44 Å²	44	8%	0.083	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	165	-179	-59	-81.8	0	0	0	112	V216 A217 K219 L238 V252 R253 L266	V216-F268 VanDerWaalsContact CB-O 3.32Å; V216-F268 WeakPolarHBondContact CB-O 3.2Å; A217-F268 HydrophobicContact CB-CB 4.46Å; A217-F268 PolarHBondContact N-O 2.86Å; A217-F268 VanDerWaalsContact N-O 3.14Å; A217-F268 PolarHBondContact O-N 3.34Å; K219-F268 HydrophobicContact CB-CD2 4.48Å; K219-F268 HydrophobicContact CB-CE2 3.87Å; K219-F268 HydrophobicContact CD-CE2 4.46Å; L238-F268 HydrophobicContact CD1-CE1 3.83Å; L238-F268 HydrophobicContact CD1-CZ 3.67Å; L238-F268 HydrophobicContact CD2-CE1 3.87Å; L238-F268 HydrophobicContact CD2-CZ 4.42Å; V252-F268 HydrophobicContact CG1-CD1 3.96Å; V252-F268 HydrophobicContact CG1-CE1 4.09Å; V252-F268 HydrophobicContact CG2-CB 3.99Å; V252-F268 HydrophobicContact CG2-CD1 3.91Å; V252-F268 HydrophobicContact CG2-CG 4.26Å; R253-F268 VanDerWaalsContact O-CA 3.31Å; R253-F268 WeakPolarHBondContact O-CA 2.99Å; L266-F268 HydrophobicContact CB-CD2 4.45Å; L266-F268 HydrophobicContact CB-CE2 3.58Å; L266-F268 HydrophobicContact CB-CZ 3.85Å; L266-F268 HydrophobicContact CD1-CZ 4.35Å; L266-F268 WeakPolarHBondContact O-CD2 3.23Å
269	E	96.7	Very high	95.4	Very high	23 Å²	23	43.3 Å²	43.3	11%	0.107	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	145.6	160.1	65.7	-173.8	124.5	0	0	111.7	V252 R253 Y255 L271 K334	V252-E269 HydrophobicContact CG2-CG 3.81Å; R253-E269 HydrophobicContact CB-CG 4.3Å; R253-E269 WeakPolarHBondContact CB-OE1 3.49Å; R253-E269 PolarHBondContact N-OE1 3.42Å; R253-E269 PolarHBondContact O-N 2.84Å; R253-E269 VanDerWaalsContact O-N 3.12Å; Y255-E269 HydrophobicContact CE2-CB 4.16Å; E269-L271 HydrophobicContact CG-CD2 4.02Å; E269-L271 HydrophobicContact CG-CG 4.19Å; E269-K334 VanDerWaalsContact OE1-CD 3.23Å; E269-K334 WeakPolarHBondContact OE1-CD 3.32Å; E269-K334 IonicContact OE1-NZ 2.73Å; E269-K334 PolarHBondContact OE1-NZ 2.9Å; E269-K334 IonicContact OE2-NZ 3.73Å; E269-K334 PolarHBondContact OE2-NZ 2.75Å
270	M	96.3	Very high	95.6	Very high	45 Å²	45	41.2 Å²	41.2	22%	0.222	20%	0.196	C	C	.	.			trans	-78.7	132.4	171.1	-173.6	68.6	-164.5	0	0	109.3	L196 K206 I215 A217	L196-M270 HydrophobicContact CD1-CE 3.82Å; L196-M270 HydrophobicContact CD1-SD 3.95Å; L196-M270 HydrophobicContact CD2-CE 4.07Å; K206-M270 HydrophobicContact CD-CE 4.29Å; K206-M270 HydrophobicContact CG-CE 4.22Å; K206-M270 HydrophobicContact CG-SD 4.07Å; I215-M270 HydrophobicContact CG2-CB 4.09Å; I215-M270 HydrophobicContact CG2-CG 3.89Å; I215-M270 HydrophobicContact CG2-SD 4.3Å; A217-M270 HydrophobicContact CB-SD 4.28Å
271	L	96.7	Very high	95.8	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.052	22%	0.221	C	C	.	.			trans	-125.3	148	175.7	-57.6	175.4	0	0	0	108.7	V252 E269 M322 V324 K334 I336	V252-L271 HydrophobicContact CG2-CD1 4.15Å; E269-L271 HydrophobicContact CG-CD2 4.02Å; E269-L271 HydrophobicContact CG-CG 4.19Å; L271-M322 HydrophobicContact CB-CB 3.98Å; L271-M322 HydrophobicContact CB-CE 3.79Å; L271-M322 HydrophobicContact CB-SD 3.99Å; L271-M322 HydrophobicContact CD1-CB 3.82Å; L271-M322 HydrophobicContact CD1-SD 4.37Å; L271-M322 WeakPolarHBondContact O-CE 3.45Å; L271-V324 HydrophobicContact CD2-CB 4.33Å; L271-V324 HydrophobicContact CD2-CG1 4.2Å; L271-V324 HydrophobicContact CD2-CG2 4.12Å; L271-K334 HydrophobicContact CD1-CB 4.12Å; L271-K334 HydrophobicContact CD2-CD 4.35Å; L271-I336 HydrophobicContact CD1-CG2 3.81Å
272	E	94.9	Very high	95.9	Very high	132 Å²	132	44.5 Å²	44.5	62%	0.617	22%	0.215	S	C	*	.			trans	-79.2	-51.7	-168.7	-74.3	-67.5	149.2	0	0	114.1	L323 P326	E272-L323 PolarHBondContact N-O 3.03Å; E272-P326 HydrophobicContact CB-CG 4.37Å
273	Q	95.5	Very high	96.2	Very high	24 Å²	24	47.5 Å²	47.5	11%	0.112	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	134.2	-164.1	-173.9	177.9	33.4	0	0	113.7	D277 F278 M322 L323 P326	Q273-D277 HydrophobicContact CG-CB 4.36Å; Q273-D277 PolarHBondContact NE2-O 3.45Å; Q273-F278 HydrophobicContact CG-CB 4.34Å; Q273-M322 CarbonylContact O-C 3.15Å; Q273-M322 WeakPolarHBondContact O-CA 3.27Å; Q273-L323 WeakPolarHBondContact O-CB 3.41Å; Q273-L323 PolarHBondContact O-N 3.39Å; Q273-P326 HydrophobicContact CB-CG 4.41Å
274	N	97.6	Very high	96.4	Very high	28 Å²	28	49.8 Å²	49.8	15%	0.15	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	157.3	171.8	70.1	73.9	0	0	0	112.7	Y276 D277 F278 E319 I321 M322	N274-Y276 VanDerWaalsContact C-N 3.29Å; N274-Y276 PolarHBondContact O-N 2.82Å; N274-Y276 WeakPolarHBondContact OD1-CA 3.48Å; N274-Y276 WeakPolarHBondContact OD1-CB 3.47Å; N274-Y276 PolarHBondContact OD1-N 2.89Å; N274-Y276 VanDerWaalsContact OD1-N 3.1Å; N274-D277 PolarHBondContact ND2-OD2 2.85Å; N274-D277 PolarHBondContact O-N 2.81Å; N274-D277 PolarHBondContact OD1-N 3.17Å; N274-F278 PolarHBondContact O-N 2.96Å; N274-E319 VanDerWaalsContact CB-O 3.28Å; N274-E319 WeakPolarHBondContact CB-O 3.37Å; N274-I321 WeakPolarHBondContact CA-O 3Å; N274-M322 HydrophobicContact CB-CG 4.05Å
275	L	98.4	Very high	96.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.7	-25.4	-175.9	-67.8	-178.9	0	0	0	114	L279 I295 P318 I321 L323 V333 L385	L275-L279 PolarHBondContact O-N 2.81Å; L275-I295 HydrophobicContact CD1-CG2 3.76Å; L275-I295 HydrophobicContact CD2-CD1 4.07Å; L275-P318 HydrophobicContact CB-CB 3.93Å; L275-P318 WeakPolarHBondContact CB-O 3.2Å; L275-P318 PolarHBondContact N-O 3.44Å; L275-I321 HydrophobicContact CD1-CB 3.85Å; L275-I321 HydrophobicContact CD1-CD1 4.33Å; L275-I321 HydrophobicContact CD1-CG2 3.54Å; L275-I321 HydrophobicContact CG-CB 4.19Å; L275-I321 HydrophobicContact CG-CG2 4.01Å; L275-I321 PolarHBondContact N-O 3.03Å; L275-L323 HydrophobicContact CD2-CD1 4.27Å; L275-L323 HydrophobicContact CD2-CD2 4.31Å; L275-L323 HydrophobicContact CD2-CG 4.06Å; L275-V333 HydrophobicContact CD2-CG1 4.35Å; L275-L385 HydrophobicContact CD1-CD1 4.32Å; L275-L385 HydrophobicContact CD1-CD2 4.42Å
276	Y	97.6	Very high	96.6	Very high	86 Å²	86	53 Å²	53	34%	0.337	26%	0.255	S	S	.	.	H	α-helix	trans	-68.2	-49.7	174.2	174.3	-105.3	0	0	0	111.5	N274 F278 L279 K280 F284 E319	N274-Y276 VanDerWaalsContact C-N 3.29Å; N274-Y276 PolarHBondContact O-N 2.82Å; N274-Y276 WeakPolarHBondContact OD1-CA 3.48Å; N274-Y276 WeakPolarHBondContact OD1-CB 3.47Å; N274-Y276 PolarHBondContact OD1-N 2.89Å; N274-Y276 VanDerWaalsContact OD1-N 3.1Å; Y276-F278 VanDerWaalsContact C-N 3.26Å; Y276-F278 PolarHBondContact O-N 3.31Å; Y276-L279 PolarHBondContact O-N 3.32Å; Y276-K280 HydrophobicContact CE1-CD 4.05Å; Y276-K280 VanDerWaalsContact O-CB 3.26Å; Y276-K280 WeakPolarHBondContact O-CB 3.31Å; Y276-K280 PolarHBondContact O-N 2.82Å; Y276-F284 AromaticContact CE2-CE1 3.97Å; Y276-F284 HydrophobicContact CE2-CE1 3.97Å; Y276-F284 HydrophobicContact CE2-CZ 4.23Å; Y276-E319 HydrophobicContact CG-CG 4.37Å
277	D	97.1	Very high	96.7	Very high	51 Å²	51	53.6 Å²	53.6	27%	0.273	26%	0.258	S	S	.	.	H	α-helix	trans	-66.6	-28.2	175.8	-78.4	-57.1	0	0	0	112.2	Q273 N274 K280 Q281	Q273-D277 HydrophobicContact CG-CB 4.36Å; Q273-D277 PolarHBondContact NE2-O 3.45Å; N274-D277 PolarHBondContact ND2-OD2 2.85Å; N274-D277 PolarHBondContact O-N 2.81Å; N274-D277 PolarHBondContact OD1-N 3.17Å; D277-K280 WeakPolarHBondContact OD1-CD 3.4Å; D277-K280 IonicContact OD1-NZ 2.89Å; D277-K280 PolarHBondContact OD1-NZ 2.81Å; D277-Q281 WeakPolarHBondContact O-CB 3.29Å; D277-Q281 WeakPolarHBondContact O-CG 3.39Å; D277-Q281 PolarHBondContact O-N 3.38Å
278	F	97	Very high	96.7	Very high	26 Å²	26	56.6 Å²	56.6	11%	0.114	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-48.6	169.6	178	-101.1	0	0	0	112.1	Q273 N274 Y276 K280 Q281 N282 L287 L323 Y331	Q273-F278 HydrophobicContact CG-CB 4.34Å; N274-F278 PolarHBondContact O-N 2.96Å; Y276-F278 VanDerWaalsContact C-N 3.26Å; Y276-F278 PolarHBondContact O-N 3.31Å; F278-K280 VanDerWaalsContact C-N 3.33Å; F278-K280 PolarHBondContact O-N 3.44Å; F278-Q281 PolarHBondContact O-N 3.23Å; F278-N282 WeakPolarHBondContact CE1-ND2 3.06Å; F278-N282 VanDerWaalsContact CE2-ND2 3.35Å; F278-N282 WeakPolarHBondContact CE2-ND2 3.38Å; F278-N282 WeakPolarHBondContact CZ-ND2 3.36Å; F278-N282 WeakPolarHBondContact O-CB 3.5Å; F278-N282 PolarHBondContact O-N 2.62Å; F278-N282 PolarHBondContact O-ND2 3.41Å; F278-L287 HydrophobicContact CE1-CD1 4.12Å; F278-L287 HydrophobicContact CE1-CD2 4.33Å; F278-L323 HydrophobicContact CB-CD1 4.02Å; F278-L323 HydrophobicContact CD2-CD1 3.63Å; F278-L323 HydrophobicContact CE2-CD1 4.24Å; F278-L323 HydrophobicContact CG-CD1 3.82Å; F278-Y331 HydrophobicContact CE1-CE1 4.35Å; F278-Y331 AromaticContact CZ-CE1 3.88Å; F278-Y331 HydrophobicContact CZ-CE1 3.88Å
279	L	97.1	Very high	96.7	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-43.2	173.9	-77.5	178.3	0	0	0	111.7	L275 Y276 N282 K283 F284 E384 L385	L275-L279 PolarHBondContact O-N 2.81Å; Y276-L279 PolarHBondContact O-N 3.32Å; L279-N282 CarbonylContact O-C 3.57Å; L279-N282 WeakPolarHBondContact O-CA 2.93Å; L279-N282 PolarHBondContact O-N 3.05Å; L279-K283 PolarHBondContact O-N 3.03Å; L279-K283 VanDerWaalsContact O-N 3.12Å; L279-F284 HydrophobicContact CB-CD1 4.3Å; L279-F284 PolarHBondContact O-N 2.66Å; L279-E384 HydrophobicContact CD1-CG 3.99Å; L279-L385 HydrophobicContact CD1-CD2 4.13Å; L279-L385 HydrophobicContact CD2-CD2 4.17Å; L279-L385 HydrophobicContact CG-CD2 4.13Å
280	K	97.1	Very high	96.6	Very high	102 Å²	102	56.5 Å²	56.5	44%	0.443	28%	0.277	S	S	.	.	H	α-helix	trans	-63.8	-41.9	179.6	178.2	176.2	154.3	-152.8	0	112.9	Y276 D277 F278 N282 K283 F284	Y276-K280 HydrophobicContact CE1-CD 4.05Å; Y276-K280 VanDerWaalsContact O-CB 3.26Å; Y276-K280 WeakPolarHBondContact O-CB 3.31Å; Y276-K280 PolarHBondContact O-N 2.82Å; D277-K280 WeakPolarHBondContact OD1-CD 3.4Å; D277-K280 IonicContact OD1-NZ 2.89Å; D277-K280 PolarHBondContact OD1-NZ 2.81Å; F278-K280 VanDerWaalsContact C-N 3.33Å; F278-K280 PolarHBondContact O-N 3.44Å; K280-N282 VanDerWaalsContact C-N 3.34Å; K280-K283 WeakPolarHBondContact O-CA 3.49Å; K280-K283 PolarHBondContact O-N 3.41Å; K280-F284 HydrophobicContact CB-CE1 4.05Å; K280-F284 HydrophobicContact CB-CE2 4.14Å; K280-F284 HydrophobicContact CB-CZ 3.64Å; K280-F284 HydrophobicContact CD-CZ 4.4Å; K280-F284 HydrophobicContact CG-CE2 4.09Å; K280-F284 HydrophobicContact CG-CZ 3.86Å
281	Q	96.4	Very high	96.7	Very high	140 Å²	140	57.1 Å²	57.1	65%	0.654	28%	0.277	S	S	*	.	H	α-helix	trans	-64.8	-39.1	171.3	-77	-178.7	6	0	0	111.7	D277 F278 K283	D277-Q281 WeakPolarHBondContact O-CB 3.29Å; D277-Q281 WeakPolarHBondContact O-CG 3.39Å; D277-Q281 PolarHBondContact O-N 3.38Å; F278-Q281 PolarHBondContact O-N 3.23Å; Q281-K283 PolarHBondContact O-N 3.11Å
282	N	94.8	Very high	96.8	Very high	67 Å²	67	56.7 Å²	56.7	36%	0.358	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	18.2	169.3	-67.7	-54.1	0	0	0	113.4	F278 L279 K280 F284 S285	F278-N282 WeakPolarHBondContact CE1-ND2 3.06Å; F278-N282 VanDerWaalsContact CE2-ND2 3.35Å; F278-N282 WeakPolarHBondContact CE2-ND2 3.38Å; F278-N282 WeakPolarHBondContact CZ-ND2 3.36Å; F278-N282 WeakPolarHBondContact O-CB 3.5Å; F278-N282 PolarHBondContact O-N 2.62Å; F278-N282 PolarHBondContact O-ND2 3.41Å; L279-N282 CarbonylContact O-C 3.57Å; L279-N282 WeakPolarHBondContact O-CA 2.93Å; L279-N282 PolarHBondContact O-N 3.05Å; K280-N282 VanDerWaalsContact C-N 3.34Å; N282-F284 PolarHBondContact O-N 2.94Å; N282-S285 WeakPolarHBondContact O-CB 3.31Å; N282-S285 PolarHBondContact O-N 2.89Å; N282-S285 PolarHBondContact O-OG 3.04Å
283	K	97	Very high	96.9	Very high	185 Å²	185	50.4 Å²	50.4	80%	0.804	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	32.4	174.7	-54.5	178.1	-176.8	173.9	0	114.4	L279 K280 Q281 S285	L279-K283 PolarHBondContact O-N 3.03Å; L279-K283 VanDerWaalsContact O-N 3.12Å; K280-K283 WeakPolarHBondContact O-CA 3.49Å; K280-K283 PolarHBondContact O-N 3.41Å; Q281-K283 PolarHBondContact O-N 3.11Å; K283-S285 PolarHBondContact O-N 3.13Å
284	F	96.9	Very high	97.1	Very high	64 Å²	64	49.2 Å²	49.2	28%	0.281	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	36.5	-176	-59.9	-73	0	0	0	112.9	Y276 L279 K280 N282 G388	Y276-F284 AromaticContact CE2-CE1 3.97Å; Y276-F284 HydrophobicContact CE2-CE1 3.97Å; Y276-F284 HydrophobicContact CE2-CZ 4.23Å; L279-F284 HydrophobicContact CB-CD1 4.3Å; L279-F284 PolarHBondContact O-N 2.66Å; K280-F284 HydrophobicContact CB-CE1 4.05Å; K280-F284 HydrophobicContact CB-CE2 4.14Å; K280-F284 HydrophobicContact CB-CZ 3.64Å; K280-F284 HydrophobicContact CD-CZ 4.4Å; K280-F284 HydrophobicContact CG-CE2 4.09Å; K280-F284 HydrophobicContact CG-CZ 3.86Å; N282-F284 PolarHBondContact O-N 2.94Å; F284-G388 WeakPolarHBondContact CB-O 3.43Å
285	S	96.4	Very high	97.1	Very high	58 Å²	58	48 Å²	48	41%	0.406	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-78.1	143.3	171.3	56.4	0	0	0	0	111.6	N282 K283 L287	N282-S285 WeakPolarHBondContact O-CB 3.31Å; N282-S285 PolarHBondContact O-N 2.89Å; N282-S285 PolarHBondContact O-OG 3.04Å; K283-S285 PolarHBondContact O-N 3.13Å; S285-L287 PolarHBondContact O-N 3.49Å
286	P	96.5	Very high	97.2	Very high	46 Å²	46	48 Å²	48	30%	0.299	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-54.7	129.9	171.4	-29.6	37.6	0	0	0	112.9	F386 N471	P286-F386 WeakPolarHBondContact CB-O 3.29Å; P286-N471 HydrophobicContact CB-CB 4.24Å; P286-N471 HydrophobicContact CG-CB 4.06Å; P286-N471 VanDerWaalsContact CG-ND2 3.27Å; P286-N471 WeakPolarHBondContact CG-ND2 3.49Å
287	L	96.4	Very high	97.2	Very high	17 Å²	17	45.6 Å²	45.6	9%	0.089	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-88.1	126.5	176.1	-167.3	68.7	0	0	0	110.6	F278 S285 Y291 I292 I295 L385	F278-L287 HydrophobicContact CE1-CD1 4.12Å; F278-L287 HydrophobicContact CE1-CD2 4.33Å; S285-L287 PolarHBondContact O-N 3.49Å; L287-Y291 HydrophobicContact CD1-CD2 3.8Å; L287-Y291 HydrophobicContact CD1-CG 4.44Å; L287-Y291 HydrophobicContact CG-CD2 4.25Å; L287-I292 HydrophobicContact CB-CD1 4.31Å; L287-I292 HydrophobicContact CB-CG1 4.16Å; L287-I292 HydrophobicContact CD2-CG1 3.94Å; L287-I292 HydrophobicContact CG-CG1 4.2Å; L287-I292 VanDerWaalsContact O-CD1 3.24Å; L287-I292 WeakPolarHBondContact O-CD1 3.47Å; L287-I295 HydrophobicContact CD2-CD1 4.27Å; L287-L385 VanDerWaalsContact CB-O 3.3Å; L287-L385 WeakPolarHBondContact CB-O 3.32Å; L287-L385 HydrophobicContact CD2-CD2 4.33Å; L287-L385 PolarHBondContact N-O 3.29Å
288	P	96.3	Very high	97.3	Very high	64 Å²	64	43.3 Å²	43.3	42%	0.416	21%	0.213	S	C	.	.	P	Polyproline II helix	trans	-56.3	142.4	175.3	-30.5	36.3	0	0	0	114.1	K290 Y291 I292	P288-K290 HydrophobicContact CB-CG 4.19Å; P288-K290 PolarHBondContact O-N 3.01Å; P288-Y291 HydrophobicContact CB-CD2 4.07Å; P288-Y291 HydrophobicContact CB-CE2 4.27Å; P288-Y291 HydrophobicContact CG-CD2 4.17Å; P288-Y291 HydrophobicContact CG-CE2 4.11Å; P288-Y291 PolarHBondContact O-N 3.09Å; P288-I292 PolarHBondContact O-N 3.15Å
289	L	97.3	Very high	97.4	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-52.5	-35.5	-176.2	-72	178.7	0	0	0	114	Y291 I292 R293 F386 D487 R488 Y491 F517	L289-Y291 PolarHBondContact O-N 2.96Å; L289-Y291 VanDerWaalsContact O-N 3.15Å; L289-I292 HydrophobicContact CD2-CD1 4.46Å; L289-I292 PolarHBondContact O-N 3.41Å; L289-I292 VanDerWaalsContact O-N 3.1Å; L289-R293 PolarHBondContact O-N 3.18Å; L289-F386 HydrophobicContact CD1-CE2 4.4Å; L289-F386 HydrophobicContact CD2-CD2 3.57Å; L289-F386 HydrophobicContact CD2-CE2 3.75Å; L289-F386 HydrophobicContact CG-CD2 4.18Å; L289-F386 HydrophobicContact CG-CE2 4.02Å; L289-D487 HydrophobicContact CD1-CB 4.2Å; L289-R488 HydrophobicContact CD1-CB 4.21Å; L289-R488 HydrophobicContact CD1-CG 3.53Å; L289-Y491 HydrophobicContact CD1-CG 4.31Å; L289-Y491 HydrophobicContact CD2-CD1 3.69Å; L289-Y491 HydrophobicContact CD2-CD2 3.54Å; L289-Y491 HydrophobicContact CD2-CE1 4.05Å; L289-Y491 HydrophobicContact CD2-CE2 3.91Å; L289-Y491 HydrophobicContact CD2-CG 3.42Å; L289-Y491 VanDerWaalsContact CD2-CG 3.42Å; L289-F517 HydrophobicContact CB-CE2 4.16Å; L289-F517 HydrophobicContact CB-CZ 4.33Å; L289-F517 HydrophobicContact CD1-CE2 4.28Å; L289-F517 HydrophobicContact CD2-CE2 4.14Å; L289-F517 HydrophobicContact CD2-CZ 4.12Å; L289-F517 HydrophobicContact CG-CE2 4.44Å
290	K	96.2	Very high	97.5	Very high	40 Å²	40	42 Å²	42	17%	0.174	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-20.6	177	69.3	-176.6	-175.2	178	0	115.2	P288 P294 S534 C535 N538	P288-K290 HydrophobicContact CB-CG 4.19Å; P288-K290 PolarHBondContact O-N 3.01Å; K290-P294 VanDerWaalsContact O-CD 3.28Å; K290-P294 WeakPolarHBondContact O-CD 3.2Å; K290-S534 PolarHBondContact NZ-OG 3.15Å; K290-C535 HydrophobicContact CB-CB 4.46Å; K290-C535 VanDerWaalsContact CB-SG 3.52Å; K290-N538 VanDerWaalsContact O-CB 3.28Å; K290-N538 WeakPolarHBondContact O-CB 3.49Å
291	Y	97.4	Very high	97.5	Very high	58 Å²	58	37.9 Å²	37.9	23%	0.227	19%	0.19	C	C	.	.	H	α-helix	trans	-99.9	-27	173.7	-51.8	-43.6	0	0	0	112.3	L287 P288 L289 P294 I295 Y331 N538	L287-Y291 HydrophobicContact CD1-CD2 3.8Å; L287-Y291 HydrophobicContact CD1-CG 4.44Å; L287-Y291 HydrophobicContact CG-CD2 4.25Å; P288-Y291 HydrophobicContact CB-CD2 4.07Å; P288-Y291 HydrophobicContact CB-CE2 4.27Å; P288-Y291 HydrophobicContact CG-CD2 4.17Å; P288-Y291 HydrophobicContact CG-CE2 4.11Å; P288-Y291 PolarHBondContact O-N 3.09Å; L289-Y291 PolarHBondContact O-N 2.96Å; L289-Y291 VanDerWaalsContact O-N 3.15Å; Y291-P294 WeakPolarHBondContact O-CD 3.08Å; Y291-P294 WeakPolarHBondContact O-CG 3.44Å; Y291-I295 WeakPolarHBondContact O-CG1 3.39Å; Y291-Y331 AromaticContact CD1-CD2 3.93Å; Y291-Y331 HydrophobicContact CD1-CD2 3.93Å; Y291-Y331 HydrophobicContact CD1-CE1 4.47Å; Y291-Y331 AromaticContact CD1-CE2 3.22Å; Y291-Y331 HydrophobicContact CD1-CE2 3.22Å; Y291-Y331 AromaticContact CD1-CZ 3.55Å; Y291-Y331 HydrophobicContact CD2-CE2 4.46Å; Y291-Y331 AromaticContact CD2-CZ 3.94Å; Y291-Y331 WeakPolarHBondContact CD2-OH 3.38Å; Y291-Y331 AromaticContact CE1-CE2 3.75Å; Y291-Y331 HydrophobicContact CE1-CE2 3.75Å; Y291-Y331 HydrophobicContact CG-CD2 4.38Å; Y291-Y331 HydrophobicContact CG-CE1 4.06Å; Y291-Y331 AromaticContact CG-CE2 3.66Å; Y291-Y331 HydrophobicContact CG-CE2 3.66Å; Y291-Y331 AromaticContact CG-CZ 3.46Å; Y291-Y331 VanDerWaalsContact CG-CZ 3.46Å; Y291-N538 VanDerWaalsContact CD1-OD1 3.31Å; Y291-N538 WeakPolarHBondContact CD1-OD1 3.46Å; Y291-N538 VanDerWaalsContact CE1-OD1 3.32Å; Y291-N538 WeakPolarHBondContact CE1-OD1 3.42Å
292	I	98.6	Very high	97.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.6	-40.2	172.6	-62.3	178.9	0	0	0	110.9	L287 P288 L289 I295 L296 I382 L385 F386	L287-I292 HydrophobicContact CB-CD1 4.31Å; L287-I292 HydrophobicContact CB-CG1 4.16Å; L287-I292 HydrophobicContact CD2-CG1 3.94Å; L287-I292 HydrophobicContact CG-CG1 4.2Å; L287-I292 VanDerWaalsContact O-CD1 3.24Å; L287-I292 WeakPolarHBondContact O-CD1 3.47Å; P288-I292 PolarHBondContact O-N 3.15Å; L289-I292 HydrophobicContact CD2-CD1 4.46Å; L289-I292 PolarHBondContact O-N 3.41Å; L289-I292 VanDerWaalsContact O-N 3.1Å; I292-I295 PolarHBondContact O-N 3.05Å; I292-L296 WeakPolarHBondContact O-CB 3.34Å; I292-L296 PolarHBondContact O-N 3.35Å; I292-I382 HydrophobicContact CG2-CB 3.96Å; I292-I382 HydrophobicContact CG2-CG2 4.03Å; I292-L385 HydrophobicContact CD1-CB 3.75Å; I292-L385 HydrophobicContact CG1-CB 3.89Å; I292-L385 HydrophobicContact CG2-CD1 4.45Å; I292-F386 HydrophobicContact CD1-CB 3.7Å; I292-F386 HydrophobicContact CD1-CD2 4.38Å
293	R	98.4	Very high	97.8	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-54.5	-50.1	-178.5	-167.7	-170.6	-63.8	106.9	3.5	114.3	L289 L296 Q297 D487 F517 C535 M539	L289-R293 PolarHBondContact O-N 3.18Å; R293-L296 PolarHBondContact O-N 3.06Å; R293-Q297 WeakPolarHBondContact O-CB 3.44Å; R293-Q297 PolarHBondContact O-N 2.99Å; R293-D487 IonicContact CZ-OD1 2.99Å; R293-D487 IonicContact CZ-OD2 3.03Å; R293-D487 IonicContact NH2-OD1 2.81Å; R293-D487 PolarHBondContact NH2-OD1 3.37Å; R293-D487 IonicContact NH2-OD2 3.93Å; R293-D487 PolarHBondContact NH2-OD2 3.39Å; R293-F517 HydrophobicContact CB-CE1 3.94Å; R293-F517 HydrophobicContact CB-CZ 3.89Å; R293-F517 WeakPolarHBondContact CD-O 3.44Å; R293-F517 HydrophobicContact CG-CD1 4.38Å; R293-F517 HydrophobicContact CG-CE1 3.97Å; R293-F517 HydrophobicContact CG-CZ 4.25Å; R293-F517 PolarHBondContact NE-O 3.3Å; R293-C535 VanDerWaalsContact NH1-CB 3.3Å; R293-C535 PolarHBondContact NH1-SG 2.79Å; R293-M539 HydrophobicContact CB-SD 4.04Å; R293-M539 HydrophobicContact CG-CE 4.16Å; R293-M539 HydrophobicContact CG-CG 4.47Å; R293-M539 HydrophobicContact CG-SD 3.59Å; R293-M539 VanDerWaalsContact CG-SD 3.59Å
294	P	98.3	Very high	97.9	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-36.5	177.9	23.7	-33.9	0	0	0	113	K290 Y291 Q297 Q298 M539 I541 C542	K290-P294 VanDerWaalsContact O-CD 3.28Å; K290-P294 WeakPolarHBondContact O-CD 3.2Å; Y291-P294 WeakPolarHBondContact O-CD 3.08Å; Y291-P294 WeakPolarHBondContact O-CG 3.44Å; P294-Q297 PolarHBondContact O-N 3.3Å; P294-Q298 WeakPolarHBondContact O-CG 3.49Å; P294-Q298 PolarHBondContact O-N 3.17Å; P294-Q298 VanDerWaalsContact O-N 3.11Å; P294-Q298 PolarHBondContact O-NE2 2.84Å; P294-M539 HydrophobicContact CB-SD 3.93Å; P294-M539 HydrophobicContact CG-SD 4.46Å; P294-I541 HydrophobicContact CB-CG2 3.69Å; P294-C542 VanDerWaalsContact CA-SG 3.53Å; P294-C542 VanDerWaalsContact CB-SG 3.59Å
295	I	98.8	Very high	98	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.015	11%	0.11	C	C	.	.	H	α-helix	trans	-60.1	-50	173.8	-63.7	171.6	0	0	0	109.7	L275 L287 Y291 I292 Q297 Q298 V299 Y331 V333 L385	L275-I295 HydrophobicContact CD1-CG2 3.76Å; L275-I295 HydrophobicContact CD2-CD1 4.07Å; L287-I295 HydrophobicContact CD2-CD1 4.27Å; Y291-I295 WeakPolarHBondContact O-CG1 3.39Å; I292-I295 PolarHBondContact O-N 3.05Å; I295-Q297 PolarHBondContact O-N 2.81Å; I295-Q298 PolarHBondContact O-N 3.41Å; I295-V299 WeakPolarHBondContact O-CG2 3.43Å; I295-V299 PolarHBondContact O-N 3.46Å; I295-Y331 HydrophobicContact CD1-CD1 4.18Å; I295-V333 HydrophobicContact CG1-CG1 4.24Å; I295-V333 HydrophobicContact CG2-CG1 4.4Å; I295-V333 HydrophobicContact CG2-CG2 4.27Å; I295-L385 HydrophobicContact CD1-CD1 4.32Å; I295-L385 HydrophobicContact CG2-CD1 4.26Å
296	L	98.8	Very high	98.1	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-58.9	-45	178.4	171.2	58.3	0	0	0	112	I292 R293 Q298 V299 A300 L378 I382 L494 M498 T512 F517 V518	I292-L296 WeakPolarHBondContact O-CB 3.34Å; I292-L296 PolarHBondContact O-N 3.35Å; R293-L296 PolarHBondContact O-N 3.06Å; L296-Q298 VanDerWaalsContact C-N 3.34Å; L296-Q298 PolarHBondContact O-N 3.15Å; L296-V299 PolarHBondContact O-N 3.42Å; L296-A300 WeakPolarHBondContact O-CB 3.32Å; L296-A300 PolarHBondContact O-N 3.24Å; L296-L378 HydrophobicContact CD1-CD1 3.95Å; L296-L378 HydrophobicContact CD1-CD2 3.76Å; L296-L378 HydrophobicContact CD1-CG 3.85Å; L296-I382 HydrophobicContact CB-CG2 4.14Å; L296-I382 HydrophobicContact CD1-CD1 4.47Å; L296-I382 HydrophobicContact CD1-CG2 4.05Å; L296-I382 HydrophobicContact CD2-CD1 4.11Å; L296-I382 HydrophobicContact CG-CG2 4.45Å; L296-L494 HydrophobicContact CD2-CD2 3.77Å; L296-M498 HydrophobicContact CD1-CE 3.58Å; L296-M498 HydrophobicContact CD2-CE 4.25Å; L296-T512 HydrophobicContact CD1-CG2 4.21Å; L296-F517 HydrophobicContact CD2-CD1 3.88Å; L296-F517 HydrophobicContact CD2-CE1 3.79Å; L296-V518 HydrophobicContact CD2-CG2 4.08Å; L296-V518 HydrophobicContact CG-CG2 4.45Å
297	Q	98.7	Very high	98.1	Very high	34 Å²	34	19.4 Å²	19.4	16%	0.159	10%	0.095	C	C	.	.	H	α-helix	trans	-60.6	-43.8	179.3	-172.6	-74.2	-29.7	0	0	111.4	R293 P294 I295 T301 L513 V518 M539 C542	R293-Q297 WeakPolarHBondContact O-CB 3.44Å; R293-Q297 PolarHBondContact O-N 2.99Å; P294-Q297 PolarHBondContact O-N 3.3Å; I295-Q297 PolarHBondContact O-N 2.81Å; Q297-T301 PolarHBondContact NE2-OG1 2.7Å; Q297-T301 WeakPolarHBondContact O-CB 3.08Å; Q297-T301 PolarHBondContact O-N 2.88Å; Q297-T301 PolarHBondContact O-OG1 3.26Å; Q297-L513 HydrophobicContact CG-CD2 3.98Å; Q297-L513 WeakPolarHBondContact O-CD2 3.25Å; Q297-V518 HydrophobicContact CB-CG1 4.01Å; Q297-V518 HydrophobicContact CG-CG1 3.87Å; Q297-M539 HydrophobicContact CB-CE 4.07Å; Q297-M539 HydrophobicContact CG-CE 4.08Å; Q297-C542 HydrophobicContact CG-CB 4.26Å; Q297-C542 VanDerWaalsContact OE1-CB 3.32Å; Q297-C542 PolarHBondContact OE1-SG 2.75Å
298	Q	98.7	Very high	98.2	Very high	3 Å²	3	22.5 Å²	22.5	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-67.1	-46.3	-179.9	-74.1	165.2	91.7	0	0	111.7	N250 P294 I295 L296 T301 A302 Y331 R332 V333	N250-Q298 HydrophobicContact CB-CB 4.06Å; N250-Q298 PolarHBondContact ND2-O 2.95Å; P294-Q298 WeakPolarHBondContact O-CG 3.49Å; P294-Q298 PolarHBondContact O-N 3.17Å; P294-Q298 VanDerWaalsContact O-N 3.11Å; P294-Q298 PolarHBondContact O-NE2 2.84Å; I295-Q298 PolarHBondContact O-N 3.41Å; L296-Q298 VanDerWaalsContact C-N 3.34Å; L296-Q298 PolarHBondContact O-N 3.15Å; Q298-T301 WeakPolarHBondContact O-CB 3.5Å; Q298-T301 PolarHBondContact O-N 2.91Å; Q298-T301 VanDerWaalsContact O-N 3.17Å; Q298-A302 PolarHBondContact O-N 3.31Å; Q298-Y331 PolarHBondContact NE2-O 3.12Å; Q298-R332 VanDerWaalsContact OE1-CA 3.24Å; Q298-R332 VanDerWaalsContact OE1-CG 3.3Å; Q298-V333 HydrophobicContact CB-CG2 3.66Å; Q298-V333 HydrophobicContact CG-CG2 4.41Å
299	V	98.9	Very high	98.2	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.006	10%	0.102	C	C	.	.	H	α-helix	trans	-69	-37.7	179.1	-178.9	0	0	0	0	111.6	I295 L296 T301 A302 L303 L316 I321 V333 V335 L378	I295-V299 WeakPolarHBondContact O-CG2 3.43Å; I295-V299 PolarHBondContact O-N 3.46Å; L296-V299 PolarHBondContact O-N 3.42Å; V299-T301 VanDerWaalsContact C-N 3.27Å; V299-T301 PolarHBondContact O-N 2.69Å; V299-A302 WeakPolarHBondContact O-CB 3.35Å; V299-A302 PolarHBondContact O-N 2.91Å; V299-A302 VanDerWaalsContact O-N 3.15Å; V299-L303 WeakPolarHBondContact O-CG 3.32Å; V299-L303 PolarHBondContact O-N 2.84Å; V299-L316 HydrophobicContact CG1-CD1 4.26Å; V299-L316 HydrophobicContact CG1-CD2 4.12Å; V299-I321 HydrophobicContact CG1-CD1 4.4Å; V299-I321 HydrophobicContact CG2-CD1 4.13Å; V299-I321 HydrophobicContact CG2-CG1 4.31Å; V299-I321 HydrophobicContact CG2-CG2 3.92Å; V299-V333 HydrophobicContact CG2-CG2 4.1Å; V299-V335 HydrophobicContact CG1-CG2 4.08Å; V299-V335 HydrophobicContact CG2-CG2 4.34Å; V299-L378 HydrophobicContact CB-CD1 4.09Å; V299-L378 HydrophobicContact CG1-CD1 3.74Å; V299-L378 HydrophobicContact CG1-CD2 4.32Å
300	A	98.8	Very high	98.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.1	-31.9	171.9	0	0	0	0	0	112.2	L296 M304 L378 P509 T512 L513	L296-A300 WeakPolarHBondContact O-CB 3.32Å; L296-A300 PolarHBondContact O-N 3.24Å; A300-M304 VanDerWaalsContact O-CB 3.31Å; A300-M304 WeakPolarHBondContact O-CB 3.44Å; A300-M304 PolarHBondContact O-N 2.94Å; A300-L378 HydrophobicContact CB-CD2 4.33Å; A300-P509 WeakPolarHBondContact O-CB 3.45Å; A300-T512 HydrophobicContact CB-CG2 3.83Å; A300-L513 HydrophobicContact CB-CD2 3.87Å; A300-L513 HydrophobicContact CB-CG 4.1Å
301	T	98.7	Very high	98.3	Very high	14 Å²	14	19.1 Å²	19.1	9%	0.086	10%	0.1	C	C	.	.	H	α-helix	trans	-67	-39.9	171.7	-56.1	0	0	0	0	111.4	Y249 Q297 Q298 V299 M304 K305	Y249-T301 HydrophobicContact CD1-CG2 4.27Å; Q297-T301 PolarHBondContact NE2-OG1 2.7Å; Q297-T301 WeakPolarHBondContact O-CB 3.08Å; Q297-T301 PolarHBondContact O-N 2.88Å; Q297-T301 PolarHBondContact O-OG1 3.26Å; Q298-T301 WeakPolarHBondContact O-CB 3.5Å; Q298-T301 PolarHBondContact O-N 2.91Å; Q298-T301 VanDerWaalsContact O-N 3.17Å; V299-T301 VanDerWaalsContact C-N 3.27Å; V299-T301 PolarHBondContact O-N 2.69Å; T301-M304 HydrophobicContact CG2-CE 4.3Å; T301-M304 WeakPolarHBondContact O-CB 2.94Å; T301-M304 PolarHBondContact O-N 2.69Å; T301-K305 PolarHBondContact O-N 2.83Å; T301-K305 VanDerWaalsContact O-N 3.13Å
302	A	98.7	Very high	98.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.2	-51.1	172.8	0	0	0	0	0	111.7	Y249 Q298 V299 M304 K305 L306 V335	Y249-A302 WeakPolarHBondContact O-CA 3.41Å; Y249-A302 WeakPolarHBondContact O-CB 3.47Å; Y249-A302 PolarHBondContact O-N 2.73Å; Q298-A302 PolarHBondContact O-N 3.31Å; V299-A302 WeakPolarHBondContact O-CB 3.35Å; V299-A302 PolarHBondContact O-N 2.91Å; V299-A302 VanDerWaalsContact O-N 3.15Å; A302-M304 VanDerWaalsContact C-N 3.29Å; A302-M304 PolarHBondContact O-N 3.38Å; A302-K305 PolarHBondContact O-N 3.47Å; A302-L306 WeakPolarHBondContact O-CG 3.49Å; A302-L306 PolarHBondContact O-N 3.45Å; A302-V335 HydrophobicContact CB-CG2 3.77Å
303	L	98.8	Very high	98.3	Very high	6 Å²	6	16.4 Å²	16.4	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-63.3	-33.6	178.5	-63.1	-170.8	0	0	0	112.7	V299 K305 L306 K307 L316 D374 M375 L378 P509	V299-L303 WeakPolarHBondContact O-CG 3.32Å; V299-L303 PolarHBondContact O-N 2.84Å; L303-K305 VanDerWaalsContact C-N 3.32Å; L303-K305 PolarHBondContact O-N 3.46Å; L303-L306 HydrophobicContact CD2-CD1 4.15Å; L303-K307 WeakPolarHBondContact O-CB 3.31Å; L303-K307 PolarHBondContact O-N 2.9Å; L303-L316 HydrophobicContact CD1-CD2 4Å; L303-L316 HydrophobicContact CD2-CD2 4.29Å; L303-D374 HydrophobicContact CD1-CB 3.97Å; L303-D374 HydrophobicContact CD2-CB 3.81Å; L303-M375 HydrophobicContact CB-SD 4.47Å; L303-M375 HydrophobicContact CD1-SD 3.71Å; L303-L378 HydrophobicContact CD1-CB 4.21Å; L303-L378 HydrophobicContact CD1-CD2 3.82Å; L303-P509 HydrophobicContact CB-CB 4.09Å; L303-P509 HydrophobicContact CB-CG 3.74Å
304	M	98.6	Very high	98.3	Very high	58 Å²	58	16.4 Å²	16.4	29%	0.286	9%	0.089	S	C	.	.	H	α-helix	trans	-59.1	-45.4	171.3	-178.3	-175.6	67.2	0	0	110.9	A300 T301 A302 S308 P509 L510 L513	A300-M304 VanDerWaalsContact O-CB 3.31Å; A300-M304 WeakPolarHBondContact O-CB 3.44Å; A300-M304 PolarHBondContact O-N 2.94Å; T301-M304 HydrophobicContact CG2-CE 4.3Å; T301-M304 WeakPolarHBondContact O-CB 2.94Å; T301-M304 PolarHBondContact O-N 2.69Å; A302-M304 VanDerWaalsContact C-N 3.29Å; A302-M304 PolarHBondContact O-N 3.38Å; M304-S308 PolarHBondContact O-N 3.07Å; M304-P509 HydrophobicContact CB-CB 3.8Å; M304-P509 VanDerWaalsContact N-CB 3.33Å; M304-L510 HydrophobicContact SD-CB 4.48Å; M304-L510 HydrophobicContact SD-CD1 3.98Å; M304-L513 HydrophobicContact CB-CD1 4.32Å; M304-L513 HydrophobicContact CE-CD1 4.13Å; M304-L513 HydrophobicContact SD-CD1 3.66Å
305	K	98.4	Very high	98.2	Very high	24 Å²	24	17 Å²	17	10%	0.104	9%	0.093	C	C	.	.	H	α-helix	trans	-69.8	-43.9	179.7	-171.6	63.9	-177	-179.2	0	112	E244 Y249 F251 T301 A302 L303 K307 S308 L309	E244-K305 WeakPolarHBondContact OE1-CE 3.29Å; E244-K305 IonicContact OE1-NZ 2.69Å; E244-K305 PolarHBondContact OE1-NZ 3.04Å; E244-K305 WeakPolarHBondContact OE2-CE 3.45Å; E244-K305 IonicContact OE2-NZ 2.75Å; E244-K305 PolarHBondContact OE2-NZ 3.34Å; Y249-K305 HydrophobicContact CD1-CB 3.83Å; Y249-K305 HydrophobicContact CD1-CD 3.98Å; Y249-K305 HydrophobicContact CD1-CG 3.92Å; Y249-K305 HydrophobicContact CD2-CD 3.87Å; Y249-K305 HydrophobicContact CD2-CG 3.79Å; Y249-K305 HydrophobicContact CE1-CB 4.45Å; Y249-K305 HydrophobicContact CE1-CD 3.85Å; Y249-K305 HydrophobicContact CE1-CG 4.32Å; Y249-K305 HydrophobicContact CE2-CD 3.7Å; Y249-K305 HydrophobicContact CE2-CG 4.17Å; Y249-K305 HydrophobicContact CG-CB 3.88Å; Y249-K305 HydrophobicContact CG-CD 4Å; Y249-K305 HydrophobicContact CG-CG 3.65Å; F251-K305 HydrophobicContact CE1-CG 4.12Å; T301-K305 PolarHBondContact O-N 2.83Å; T301-K305 VanDerWaalsContact O-N 3.13Å; A302-K305 PolarHBondContact O-N 3.47Å; L303-K305 VanDerWaalsContact C-N 3.32Å; L303-K305 PolarHBondContact O-N 3.46Å; K305-K307 VanDerWaalsContact C-N 3.33Å; K305-K307 PolarHBondContact O-N 3.39Å; K305-S308 WeakPolarHBondContact O-CB 3.44Å; K305-S308 PolarHBondContact O-N 2.73Å; K305-S308 VanDerWaalsContact O-N 3.11Å; K305-S308 PolarHBondContact O-OG 2.96Å; K305-L309 PolarHBondContact O-N 2.98Å
306	L	98.4	Very high	98.2	Very high	3 Å²	3	16.8 Å²	16.8	2%	0.016	9%	0.092	C	C	.	.	H	α-helix	trans	-57.4	-45.2	174.7	-64.8	-177.3	0	0	0	111.5	L241 A302 L303 S308 L309 G310 L311 H313 F338	L241-L306 HydrophobicContact CD1-CD2 4.46Å; L241-L306 HydrophobicContact CD2-CD2 3.77Å; A302-L306 WeakPolarHBondContact O-CG 3.49Å; A302-L306 PolarHBondContact O-N 3.45Å; L303-L306 HydrophobicContact CD2-CD1 4.15Å; L306-S308 VanDerWaalsContact C-N 3.34Å; L306-S308 PolarHBondContact O-N 3.42Å; L306-L309 CarbonylContact O-C 3.59Å; L306-L309 WeakPolarHBondContact O-CA 3.34Å; L306-L309 WeakPolarHBondContact O-CB 3.39Å; L306-L309 PolarHBondContact O-N 3.29Å; L306-G310 PolarHBondContact O-N 3.44Å; L306-G310 VanDerWaalsContact O-N 3.14Å; L306-L311 CarbonylContact C-O 3.53Å; L306-L311 HydrophobicContact CB-CB 4.23Å; L306-L311 HydrophobicContact CD2-CB 4.29Å; L306-L311 HydrophobicContact CD2-CD1 4.16Å; L306-L311 PolarHBondContact O-N 3.23Å; L306-H313 HydrophobicContact CD1-CB 4.1Å; L306-F338 HydrophobicContact CD1-CE1 3.94Å; L306-F338 HydrophobicContact CD2-CE1 3.77Å; L306-F338 HydrophobicContact CD2-CZ 4.34Å
307	K	97.9	Very high	98.2	Very high	82 Å²	82	18.1 Å²	18.1	36%	0.357	10%	0.097	S	C	.	.	H	α-helix	trans	-63.9	-35.2	175.4	-176.2	157.7	-176.8	60	0	113.2	L303 K305 L309 G310 E371	L303-K307 WeakPolarHBondContact O-CB 3.31Å; L303-K307 PolarHBondContact O-N 2.9Å; K305-K307 VanDerWaalsContact C-N 3.33Å; K305-K307 PolarHBondContact O-N 3.39Å; K307-L309 PolarHBondContact O-N 3.05Å; K307-G310 PolarHBondContact O-N 2.88Å; K307-E371 HydrophobicContact CB-CB 4.35Å; K307-E371 HydrophobicContact CB-CG 4.29Å; K307-E371 HydrophobicContact CD-CB 4.29Å; K307-E371 HydrophobicContact CG-CB 4.4Å; K307-E371 HydrophobicContact CG-CG 4.19Å; K307-E371 IonicContact NZ-OE1 2.78Å; K307-E371 PolarHBondContact NZ-OE1 2.98Å; K307-E371 IonicContact NZ-OE2 2.74Å; K307-E371 PolarHBondContact NZ-OE2 3.17Å
308	S	97.8	Very high	98.2	Very high	81 Å²	81	16.5 Å²	16.5	57%	0.566	9%	0.09	S	C	*	.	H	α-helix	trans	-64.3	-21.8	172.9	79.2	0	0	0	0	113.5	M304 K305 L306	M304-S308 PolarHBondContact O-N 3.07Å; K305-S308 WeakPolarHBondContact O-CB 3.44Å; K305-S308 PolarHBondContact O-N 2.73Å; K305-S308 VanDerWaalsContact O-N 3.11Å; K305-S308 PolarHBondContact O-OG 2.96Å; L306-S308 VanDerWaalsContact C-N 3.34Å; L306-S308 PolarHBondContact O-N 3.42Å
309	L	97.1	Very high	98.1	Very high	18 Å²	18	19.4 Å²	19.4	9%	0.094	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.1	174.5	-61.4	172.2	0	0	0	112.7	R240 L241 E244 K305 L306 K307 L311 H343	R240-L309 PolarHBondContact NH1-O 2.78Å; R240-L309 PolarHBondContact NH2-O 2.9Å; L241-L309 HydrophobicContact CD2-CD1 3.84Å; E244-L309 HydrophobicContact CG-CD1 4.49Å; K305-L309 PolarHBondContact O-N 2.98Å; L306-L309 CarbonylContact O-C 3.59Å; L306-L309 WeakPolarHBondContact O-CA 3.34Å; L306-L309 WeakPolarHBondContact O-CB 3.39Å; L306-L309 PolarHBondContact O-N 3.29Å; K307-L309 PolarHBondContact O-N 3.05Å; L309-L311 HydrophobicContact CB-CD1 3.85Å; L309-L311 HydrophobicContact CB-CG 3.89Å; L309-L311 HydrophobicContact CD1-CD1 3.98Å; L309-L311 PolarHBondContact O-N 3.3Å; L309-H343 PolarHBondContact O-NE2 2.74Å
310	G	97.1	Very high	98.1	Very high	11 Å²	11	19.9 Å²	19.9	11%	0.113	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	27.9	-172.6	0	0	0	0	0	113.2	L306 K307 H343 V344	L306-G310 PolarHBondContact O-N 3.44Å; L306-G310 VanDerWaalsContact O-N 3.14Å; K307-G310 PolarHBondContact O-N 2.88Å; G310-H343 CarbonylContact O-C 3.59Å; G310-H343 WeakPolarHBondContact O-CA 3.2Å; G310-H343 PolarHBondContact O-CD2 3.45Å; G310-V344 PolarHBondContact O-N 3.27Å
311	L	97.9	Very high	98.1	Very high	5 Å²	5	19.9 Å²	19.9	3%	0.026	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134.6	179.6	-65.5	174	0	0	0	111	I237 L241 L306 L309 S342 E371	I237-L311 HydrophobicContact CD1-CD2 4.43Å; I237-L311 HydrophobicContact CG1-CD2 4.16Å; I237-L311 HydrophobicContact CG2-CD1 4.22Å; I237-L311 HydrophobicContact CG2-CD2 4.47Å; L241-L311 HydrophobicContact CD2-CD1 4.12Å; L306-L311 CarbonylContact C-O 3.53Å; L306-L311 HydrophobicContact CB-CB 4.23Å; L306-L311 HydrophobicContact CD2-CB 4.29Å; L306-L311 HydrophobicContact CD2-CD1 4.16Å; L306-L311 PolarHBondContact O-N 3.23Å; L309-L311 HydrophobicContact CB-CD1 3.85Å; L309-L311 HydrophobicContact CB-CG 3.89Å; L309-L311 HydrophobicContact CD1-CD1 3.98Å; L309-L311 PolarHBondContact O-N 3.3Å; L311-S342 WeakPolarHBondContact CA-O 3.42Å; L311-E371 WeakPolarHBondContact O-CG 3.35Å
312	I	98.1	Very high	98	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	129.8	170.6	-48.9	174.8	0	0	0	107.1	A314 A341 S342 V344 A347 F369 E371 I373 D374	I312-A314 HydrophobicContact CG2-CB 4Å; I312-A341 VanDerWaalsContact O-CA 3.24Å; I312-A341 WeakPolarHBondContact O-CA 3.5Å; I312-A341 WeakPolarHBondContact O-CB 3.49Å; I312-S342 PolarHBondContact N-O 2.95Å; I312-S342 PolarHBondContact O-N 3.37Å; I312-V344 HydrophobicContact CD1-CB 4.32Å; I312-V344 HydrophobicContact CD1-CG2 4.38Å; I312-V344 HydrophobicContact CG1-CB 4.44Å; I312-A347 HydrophobicContact CD1-CB 4.25Å; I312-F369 HydrophobicContact CD1-CD2 4.04Å; I312-F369 HydrophobicContact CD1-CE2 3.85Å; I312-E371 HydrophobicContact CG1-CB 4.45Å; I312-E371 HydrophobicContact CG1-CG 4.01Å; I312-I373 HydrophobicContact CG2-CD1 3.6Å; I312-I373 HydrophobicContact CG2-CG1 3.69Å; I312-D374 WeakPolarHBondContact CG2-OD2 3.14Å
313	H	98.1	Very high	98	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.11	C	C	.	.			trans	-73.3	-41.6	175.8	-169.1	-94.2	0	0	0	111.5	L306 D315 L316 V335 I336 F338 A341 D374	L306-H313 HydrophobicContact CD1-CB 4.1Å; H313-D315 PolarHBondContact CE1-O 3.23Å; H313-D315 VanDerWaalsContact ND1-C 3.34Å; H313-D315 PolarHBondContact O-N 3.35Å; H313-L316 PolarHBondContact ND1-N 2.67Å; H313-V335 WeakPolarHBondContact NE2-CG1 3.47Å; H313-I336 PolarHBondContact CE1-O 3.43Å; H313-I336 PolarHBondContact NE2-O 2.91Å; H313-I336 VanDerWaalsContact NE2-O 3.12Å; H313-F338 AromaticContact CD2-CD1 3.76Å; H313-F338 AromaticContact CD2-CE1 3.58Å; H313-A341 WeakPolarHBondContact O-CA 3.32Å; H313-D374 WeakPolarHBondContact CB-OD1 3.42Å; H313-D374 PolarHBondContact N-OD2 2.84Å
314	A	97.4	Very high	97.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.			trans	61.6	-0.5	172.4	0	0	0	0	0	117	I312 L353 Q354 I373 D374	I312-A314 HydrophobicContact CG2-CB 4Å; A314-L353 HydrophobicContact CB-CD1 4.38Å; A314-Q354 WeakPolarHBondContact O-CA 3.4Å; A314-Q354 VanDerWaalsContact O-CG 3.25Å; A314-Q354 WeakPolarHBondContact O-CG 3.31Å; A314-Q354 PolarHBondContact O-N 3.01Å; A314-I373 HydrophobicContact CB-CD1 4.2Å; A314-D374 PolarHBondContact N-OD1 3.15Å
315	D	97.1	Very high	97.7	Very high	12 Å²	12	20.6 Å²	20.6	6%	0.064	11%	0.11	C	C	.	.			trans	-146.3	52	165	-165.1	37.6	0	0	0	112.6	H313 K317 N320 S355	H313-D315 PolarHBondContact CE1-O 3.23Å; H313-D315 VanDerWaalsContact ND1-C 3.34Å; H313-D315 PolarHBondContact O-N 3.35Å; D315-K317 IonicContact OD1-NZ 3.6Å; D315-K317 IonicContact OD2-NZ 2.68Å; D315-K317 PolarHBondContact OD2-NZ 2.85Å; D315-N320 PolarHBondContact O-ND2 3.16Å; D315-N320 PolarHBondContact OD2-ND2 3.08Å; D315-S355 WeakPolarHBondContact OD1-CB 3.43Å; D315-S355 PolarHBondContact OD1-N 2.95Å; D315-S355 PolarHBondContact OD1-OG 3.16Å
316	L	98.6	Very high	97.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.118	C	C	.	.			trans	-77.3	127.1	174.9	-173	72.9	0	0	0	110.6	V299 L303 H313 I321 V335 S377 L378	V299-L316 HydrophobicContact CG1-CD1 4.26Å; V299-L316 HydrophobicContact CG1-CD2 4.12Å; L303-L316 HydrophobicContact CD1-CD2 4Å; L303-L316 HydrophobicContact CD2-CD2 4.29Å; H313-L316 PolarHBondContact ND1-N 2.67Å; L316-I321 HydrophobicContact CD1-CD1 4.04Å; L316-I321 HydrophobicContact CD1-CG1 3.96Å; L316-I321 HydrophobicContact CG-CD1 4.43Å; L316-V335 HydrophobicContact CD1-CG1 3.98Å; L316-V335 HydrophobicContact CD1-CG2 4.33Å; L316-S377 WeakPolarHBondContact O-CB 3.44Å; L316-L378 HydrophobicContact CD2-CB 4.01Å
317	K	98.4	Very high	97	Very high	27 Å²	27	27.3 Å²	27.3	12%	0.117	15%	0.154	C	C	.	.	S	Bend	trans	-163.4	166.7	-175.8	63	-168.6	-170	-148.6	0	111	D315 E319 N320 I321 S355 Y358	D315-K317 IonicContact OD1-NZ 3.6Å; D315-K317 IonicContact OD2-NZ 2.68Å; D315-K317 PolarHBondContact OD2-NZ 2.85Å; K317-E319 VanDerWaalsContact C-N 3.26Å; K317-E319 WeakPolarHBondContact CB-OE2 3.42Å; K317-E319 HydrophobicContact CD-CB 4.45Å; K317-E319 WeakPolarHBondContact CD-OE2 3.25Å; K317-E319 HydrophobicContact CG-CB 4.2Å; K317-E319 VanDerWaalsContact CG-OE2 3.25Å; K317-E319 WeakPolarHBondContact CG-OE2 3.45Å; K317-E319 PolarHBondContact O-N 3.08Å; K317-N320 WeakPolarHBondContact CE-ND2 3.22Å; K317-N320 HydrophobicContact CG-CB 3.89Å; K317-N320 CarbonylContact O-C 3.58Å; K317-N320 WeakPolarHBondContact O-CA 3.44Å; K317-N320 PolarHBondContact O-N 3.08Å; K317-I321 PolarHBondContact O-N 3.16Å; K317-S355 WeakPolarHBondContact CD-OG 3.47Å; K317-S355 PolarHBondContact NZ-OG 3.15Å; K317-Y358 HydrophobicContact CB-CD2 3.52Å; K317-Y358 HydrophobicContact CB-CE2 3.45Å; K317-Y358 VanDerWaalsContact CB-CE2 3.45Å; K317-Y358 HydrophobicContact CB-CG 4.13Å; K317-Y358 HydrophobicContact CD-CE2 4.48Å
318	P	98.5	Very high	96.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-60	-31.5	-179.2	-22.3	34.6	0	0	0	113.6	L275 N320 I321 Y358 V381	L275-P318 HydrophobicContact CB-CB 3.93Å; L275-P318 WeakPolarHBondContact CB-O 3.2Å; L275-P318 PolarHBondContact N-O 3.44Å; P318-N320 VanDerWaalsContact C-N 3.27Å; P318-N320 PolarHBondContact O-N 2.87Å; P318-I321 PolarHBondContact O-N 3.25Å; P318-Y358 VanDerWaalsContact CD-CE1 3.5Å; P318-Y358 WeakPolarHBondContact CD-OH 3.32Å; P318-Y358 HydrophobicContact CG-CE1 4.06Å; P318-V381 HydrophobicContact CG-CG1 4.49Å; P318-V381 HydrophobicContact CG-CG2 4.16Å
319	E	97.1	Very high	96.4	Very high	65 Å²	65	31.7 Å²	31.7	30%	0.304	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-65.5	-30.9	173.5	-50.6	95.9	113.9	0	0	112.3	N274 Y276 K317	N274-E319 VanDerWaalsContact CB-O 3.28Å; N274-E319 WeakPolarHBondContact CB-O 3.37Å; Y276-E319 HydrophobicContact CG-CG 4.37Å; K317-E319 VanDerWaalsContact C-N 3.26Å; K317-E319 WeakPolarHBondContact CB-OE2 3.42Å; K317-E319 HydrophobicContact CD-CB 4.45Å; K317-E319 WeakPolarHBondContact CD-OE2 3.25Å; K317-E319 HydrophobicContact CG-CB 4.2Å; K317-E319 VanDerWaalsContact CG-OE2 3.25Å; K317-E319 WeakPolarHBondContact CG-OE2 3.45Å; K317-E319 PolarHBondContact O-N 3.08Å
320	N	97.9	Very high	96.3	Very high	10 Å²	10	33.9 Å²	33.9	5%	0.053	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-96.9	15.4	-177.4	-69.4	-3.6	0	0	0	113.4	D315 K317 P318 I336	D315-N320 PolarHBondContact O-ND2 3.16Å; D315-N320 PolarHBondContact OD2-ND2 3.08Å; K317-N320 WeakPolarHBondContact CE-ND2 3.22Å; K317-N320 HydrophobicContact CG-CB 3.89Å; K317-N320 CarbonylContact O-C 3.58Å; K317-N320 WeakPolarHBondContact O-CA 3.44Å; K317-N320 PolarHBondContact O-N 3.08Å; P318-N320 VanDerWaalsContact C-N 3.27Å; P318-N320 PolarHBondContact O-N 2.87Å; N320-I336 VanDerWaalsContact C-CG1 3.49Å; N320-I336 HydrophobicContact CB-CG1 4.17Å; N320-I336 WeakPolarHBondContact O-CG1 3.12Å; N320-I336 PolarHBondContact O-N 3.28Å
321	I	98.7	Very high	96.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	115.2	171	-59.7	159.7	0	0	0	107.1	N274 L275 V299 L316 K317 P318 V333 V381	N274-I321 WeakPolarHBondContact CA-O 3Å; L275-I321 HydrophobicContact CD1-CB 3.85Å; L275-I321 HydrophobicContact CD1-CD1 4.33Å; L275-I321 HydrophobicContact CD1-CG2 3.54Å; L275-I321 HydrophobicContact CG-CB 4.19Å; L275-I321 HydrophobicContact CG-CG2 4.01Å; L275-I321 PolarHBondContact N-O 3.03Å; V299-I321 HydrophobicContact CG1-CD1 4.4Å; V299-I321 HydrophobicContact CG2-CD1 4.13Å; V299-I321 HydrophobicContact CG2-CG1 4.31Å; V299-I321 HydrophobicContact CG2-CG2 3.92Å; L316-I321 HydrophobicContact CD1-CD1 4.04Å; L316-I321 HydrophobicContact CD1-CG1 3.96Å; L316-I321 HydrophobicContact CG-CD1 4.43Å; K317-I321 PolarHBondContact O-N 3.16Å; P318-I321 PolarHBondContact O-N 3.25Å; I321-V333 HydrophobicContact CG2-CB 3.86Å; I321-V333 HydrophobicContact CG2-CG1 4.09Å; I321-V333 HydrophobicContact CG2-CG2 4.25Å; I321-V381 HydrophobicContact CD1-CG1 3.92Å; I321-V381 HydrophobicContact CD1-CG2 4.4Å
322	M	98.3	Very high	96.2	Very high	34 Å²	34	37.2 Å²	37.2	17%	0.167	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	133.5	-175.4	-70.6	-167.6	75.4	0	0	112.8	L271 Q273 N274 V333 K334 I336	L271-M322 HydrophobicContact CB-CB 3.98Å; L271-M322 HydrophobicContact CB-CE 3.79Å; L271-M322 HydrophobicContact CB-SD 3.99Å; L271-M322 HydrophobicContact CD1-CB 3.82Å; L271-M322 HydrophobicContact CD1-SD 4.37Å; L271-M322 WeakPolarHBondContact O-CE 3.45Å; Q273-M322 CarbonylContact O-C 3.15Å; Q273-M322 WeakPolarHBondContact O-CA 3.27Å; N274-M322 HydrophobicContact CB-CG 4.05Å; M322-V333 CarbonylContact O-C 3.6Å; M322-V333 WeakPolarHBondContact O-CA 3.11Å; M322-K334 PolarHBondContact N-O 2.79Å; M322-K334 PolarHBondContact O-N 2.94Å; M322-I336 HydrophobicContact CB-CG2 4.34Å; M322-I336 HydrophobicContact CG-CD1 3.97Å; M322-I336 HydrophobicContact CG-CG1 4.22Å; M322-I336 HydrophobicContact CG-CG2 4.15Å; M322-I336 HydrophobicContact SD-CD1 3.82Å; M322-I336 HydrophobicContact SD-CG2 4.19Å
323	L	97.9	Very high	96.2	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	132	165.6	-66.5	161.2	0	0	0	109.7	E272 Q273 L275 F278 P326 R332 V333	E272-L323 PolarHBondContact N-O 3.03Å; Q273-L323 WeakPolarHBondContact O-CB 3.41Å; Q273-L323 PolarHBondContact O-N 3.39Å; L275-L323 HydrophobicContact CD2-CD1 4.27Å; L275-L323 HydrophobicContact CD2-CD2 4.31Å; L275-L323 HydrophobicContact CD2-CG 4.06Å; F278-L323 HydrophobicContact CB-CD1 4.02Å; F278-L323 HydrophobicContact CD2-CD1 3.63Å; F278-L323 HydrophobicContact CE2-CD1 4.24Å; F278-L323 HydrophobicContact CG-CD1 3.82Å; L323-P326 HydrophobicContact CB-CG 3.88Å; L323-P326 HydrophobicContact CD1-CG 4.06Å; L323-R332 VanDerWaalsContact CA-O 3.32Å; L323-R332 WeakPolarHBondContact CA-O 3.31Å; L323-V333 HydrophobicContact CD2-CG1 3.69Å; L323-V333 HydrophobicContact CG-CG1 4.25Å
324	V	96.4	Very high	96.2	Very high	23 Å²	23	37.1 Å²	37.1	14%	0.139	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	-55.6	-177.4	-178.6	0	0	0	0	110.8	L271 R332 K334	L271-V324 HydrophobicContact CD2-CB 4.33Å; L271-V324 HydrophobicContact CD2-CG1 4.2Å; L271-V324 HydrophobicContact CD2-CG2 4.12Å; V324-R332 HydrophobicContact CG2-CB 4.43Å; V324-R332 HydrophobicContact CG2-CG 4.12Å; V324-R332 PolarHBondContact N-O 3.5Å; V324-K334 HydrophobicContact CG2-CD 4.32Å; V324-K334 HydrophobicContact CG2-CG 4.1Å
325	D	93.6	Very high	96.3	Very high	34 Å²	34	37.2 Å²	37.2	18%	0.182	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	98.5	174.2	178.8	-27.5	0	0	0	107.4	V327 R328 Q329	D325-V327 PolarHBondContact O-N 3.34Å; D325-V327 VanDerWaalsContact O-N 3.11Å; D325-V327 WeakPolarHBondContact OD1-CA 3.4Å; D325-V327 PolarHBondContact OD1-N 3.36Å; D325-R328 HydrophobicContact CB-CB 4.49Å; D325-R328 PolarHBondContact OD1-N 2.79Å; D325-R328 VanDerWaalsContact OD2-CB 3.31Å; D325-R328 WeakPolarHBondContact OD2-CB 3.21Å; D325-R328 WeakPolarHBondContact OD2-CD 3.5Å; D325-R328 WeakPolarHBondContact OD2-CG 3.25Å; D325-R328 IonicContact OD2-NE 3.47Å; D325-R328 PolarHBondContact OD2-NE 2.96Å; D325-Q329 HydrophobicContact CB-CB 4.49Å; D325-Q329 CarbonylContact O-C 3.5Å; D325-Q329 VanDerWaalsContact O-CA 3.32Å; D325-Q329 WeakPolarHBondContact O-CA 3.41Å; D325-Q329 PolarHBondContact O-N 2.72Å
326	P	91.5	Very high	96.3	Very high	39 Å²	39	38.1 Å²	38.1	25%	0.253	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-22.1	-177.6	-24.3	31.9	0	0	0	114.6	E272 Q273 L323	E272-P326 HydrophobicContact CB-CG 4.37Å; Q273-P326 HydrophobicContact CB-CG 4.41Å; L323-P326 HydrophobicContact CB-CG 3.88Å; L323-P326 HydrophobicContact CD1-CG 4.06Å
327	V	90.6	Very high	96	Very high	130 Å²	130	40 Å²	40	79%	0.788	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-42.7	-173.5	-177.7	0	0	0	0	111.2	D325	D325-V327 PolarHBondContact O-N 3.34Å; D325-V327 VanDerWaalsContact O-N 3.11Å; D325-V327 WeakPolarHBondContact OD1-CA 3.4Å; D325-V327 PolarHBondContact OD1-N 3.36Å
328	R	92.4	Very high	95.9	Very high	205 Å²	205	38.8 Å²	38.8	77%	0.774	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-23.3	-177.3	-51.2	-177.3	-163.3	-147.9	-0.6	113.9	D325	D325-R328 HydrophobicContact CB-CB 4.49Å; D325-R328 PolarHBondContact OD1-N 2.79Å; D325-R328 VanDerWaalsContact OD2-CB 3.31Å; D325-R328 WeakPolarHBondContact OD2-CB 3.21Å; D325-R328 WeakPolarHBondContact OD2-CD 3.5Å; D325-R328 WeakPolarHBondContact OD2-CG 3.25Å; D325-R328 IonicContact OD2-NE 3.47Å; D325-R328 PolarHBondContact OD2-NE 2.96Å
329	Q	92.4	Very high	95.5	Very high	49 Å²	49	38.8 Å²	38.8	23%	0.229	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	63	-179	-59.6	-178.2	44.6	0	0	110.3	D325 Y331 R332 I541	D325-Q329 HydrophobicContact CB-CB 4.49Å; D325-Q329 CarbonylContact O-C 3.5Å; D325-Q329 VanDerWaalsContact O-CA 3.32Å; D325-Q329 WeakPolarHBondContact O-CA 3.41Å; D325-Q329 PolarHBondContact O-N 2.72Å; Q329-Y331 PolarHBondContact O-N 3.1Å; Q329-R332 HydrophobicContact CB-CB 3.96Å; Q329-R332 WeakPolarHBondContact O-CB 3.33Å; Q329-R332 PolarHBondContact O-N 2.89Å; Q329-I541 HydrophobicContact CB-CD1 4.4Å
330	P	93.6	Very high	95.3	Very high	64 Å²	64	36.9 Å²	36.9	42%	0.416	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.5	133.5	-175.8	-26.4	34.9	0	0	0	112.4	R332	P330-R332 PolarHBondContact O-N 2.82Å; P330-R332 VanDerWaalsContact O-N 3.08Å
331	Y	95.7	Very high	95.1	Very high	39 Å²	39	36.5 Å²	36.5	15%	0.153	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	59.8	11.2	-179.6	-44.1	-67.5	0	0	0	115.9	F278 Y291 I295 Q298 Q329 V333	F278-Y331 HydrophobicContact CE1-CE1 4.35Å; F278-Y331 AromaticContact CZ-CE1 3.88Å; F278-Y331 HydrophobicContact CZ-CE1 3.88Å; Y291-Y331 AromaticContact CD1-CD2 3.93Å; Y291-Y331 HydrophobicContact CD1-CD2 3.93Å; Y291-Y331 HydrophobicContact CD1-CE1 4.47Å; Y291-Y331 AromaticContact CD1-CE2 3.22Å; Y291-Y331 HydrophobicContact CD1-CE2 3.22Å; Y291-Y331 AromaticContact CD1-CZ 3.55Å; Y291-Y331 HydrophobicContact CD2-CE2 4.46Å; Y291-Y331 AromaticContact CD2-CZ 3.94Å; Y291-Y331 WeakPolarHBondContact CD2-OH 3.38Å; Y291-Y331 AromaticContact CE1-CE2 3.75Å; Y291-Y331 HydrophobicContact CE1-CE2 3.75Å; Y291-Y331 HydrophobicContact CG-CD2 4.38Å; Y291-Y331 HydrophobicContact CG-CE1 4.06Å; Y291-Y331 AromaticContact CG-CE2 3.66Å; Y291-Y331 HydrophobicContact CG-CE2 3.66Å; Y291-Y331 AromaticContact CG-CZ 3.46Å; Y291-Y331 VanDerWaalsContact CG-CZ 3.46Å; I295-Y331 HydrophobicContact CD1-CD1 4.18Å; Q298-Y331 PolarHBondContact NE2-O 3.12Å; Q329-Y331 PolarHBondContact O-N 3.1Å; Y331-V333 PolarHBondContact O-N 2.9Å
332	R	97.5	Very high	94.9	Very high	47 Å²	47	37.6 Å²	37.6	18%	0.177	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	124.1	165.8	-163.5	-176.8	179.6	-155.4	-9.7	109.5	D247 Q298 L323 V324 Q329 P330 I541	D247-R332 PolarHBondContact O-NH2 2.93Å; D247-R332 IonicContact OD1-CZ 3.44Å; D247-R332 IonicContact OD1-NH2 2.87Å; D247-R332 PolarHBondContact OD1-NH2 2.8Å; Q298-R332 VanDerWaalsContact OE1-CA 3.24Å; Q298-R332 VanDerWaalsContact OE1-CG 3.3Å; L323-R332 VanDerWaalsContact CA-O 3.32Å; L323-R332 WeakPolarHBondContact CA-O 3.31Å; V324-R332 HydrophobicContact CG2-CB 4.43Å; V324-R332 HydrophobicContact CG2-CG 4.12Å; V324-R332 PolarHBondContact N-O 3.5Å; Q329-R332 HydrophobicContact CB-CB 3.96Å; Q329-R332 WeakPolarHBondContact O-CB 3.33Å; Q329-R332 PolarHBondContact O-N 2.89Å; P330-R332 PolarHBondContact O-N 2.82Å; P330-R332 VanDerWaalsContact O-N 3.08Å; R332-I541 HydrophobicContact CB-CD1 4.13Å; R332-I541 HydrophobicContact CB-CG1 3.83Å; R332-I541 HydrophobicContact CG-CG1 4.26Å
333	V	98.4	Very high	94.8	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	155.6	-173.2	-67.9	0	0	0	0	113.1	L275 I295 Q298 V299 I321 M322 L323 Y331	L275-V333 HydrophobicContact CD2-CG1 4.35Å; I295-V333 HydrophobicContact CG1-CG1 4.24Å; I295-V333 HydrophobicContact CG2-CG1 4.4Å; I295-V333 HydrophobicContact CG2-CG2 4.27Å; Q298-V333 HydrophobicContact CB-CG2 3.66Å; Q298-V333 HydrophobicContact CG-CG2 4.41Å; V299-V333 HydrophobicContact CG2-CG2 4.1Å; I321-V333 HydrophobicContact CG2-CB 3.86Å; I321-V333 HydrophobicContact CG2-CG1 4.09Å; I321-V333 HydrophobicContact CG2-CG2 4.25Å; M322-V333 CarbonylContact O-C 3.6Å; M322-V333 WeakPolarHBondContact O-CA 3.11Å; L323-V333 HydrophobicContact CD2-CG1 3.69Å; L323-V333 HydrophobicContact CG-CG1 4.25Å; Y331-V333 PolarHBondContact O-N 2.9Å
334	K	98.6	Very high	94.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.9	167.4	-73	-177.2	171.7	177.7	0	111.1	D247 N250 E269 L271 M322 V324	D247-K334 WeakPolarHBondContact OD1-CE 3.3Å; D247-K334 IonicContact OD1-NZ 3.56Å; D247-K334 PolarHBondContact OD1-NZ 3.11Å; D247-K334 IonicContact OD2-NZ 3.85Å; N250-K334 CarbonylContact O-C 3.58Å; N250-K334 WeakPolarHBondContact O-CA 3.07Å; E269-K334 VanDerWaalsContact OE1-CD 3.23Å; E269-K334 WeakPolarHBondContact OE1-CD 3.32Å; E269-K334 IonicContact OE1-NZ 2.73Å; E269-K334 PolarHBondContact OE1-NZ 2.9Å; E269-K334 IonicContact OE2-NZ 3.73Å; E269-K334 PolarHBondContact OE2-NZ 2.75Å; L271-K334 HydrophobicContact CD1-CB 4.12Å; L271-K334 HydrophobicContact CD2-CD 4.35Å; M322-K334 PolarHBondContact N-O 2.79Å; M322-K334 PolarHBondContact O-N 2.94Å; V324-K334 HydrophobicContact CG2-CD 4.32Å; V324-K334 HydrophobicContact CG2-CG 4.1Å
335	V	98.6	Very high	94.5	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	133.9	171.2	-178.4	0	0	0	0	109.9	N250 V252 V299 A302 H313 L316	N250-V335 PolarHBondContact O-N 3.13Å; V252-V335 PolarHBondContact N-O 3.39Å; V299-V335 HydrophobicContact CG1-CG2 4.08Å; V299-V335 HydrophobicContact CG2-CG2 4.34Å; A302-V335 HydrophobicContact CB-CG2 3.77Å; H313-V335 WeakPolarHBondContact NE2-CG1 3.47Å; L316-V335 HydrophobicContact CD1-CG1 3.98Å; L316-V335 HydrophobicContact CD1-CG2 4.33Å
336	I	97.1	Very high	94.4	Very high	31 Å²	31	49.4 Å²	49.4	16%	0.159	26%	0.255	C	S	.	.			trans	-124	172	-179	65.2	149.4	0	0	0	111.9	V252 L271 H313 N320 M322	V252-I336 HydrophobicContact CB-CG2 3.89Å; V252-I336 HydrophobicContact CG1-CB 4.36Å; V252-I336 HydrophobicContact CG1-CG2 4.18Å; V252-I336 HydrophobicContact CG2-CG2 4.26Å; L271-I336 HydrophobicContact CD1-CG2 3.81Å; H313-I336 PolarHBondContact CE1-O 3.43Å; H313-I336 PolarHBondContact NE2-O 2.91Å; H313-I336 VanDerWaalsContact NE2-O 3.12Å; N320-I336 VanDerWaalsContact C-CG1 3.49Å; N320-I336 HydrophobicContact CB-CG1 4.17Å; N320-I336 WeakPolarHBondContact O-CG1 3.12Å; N320-I336 PolarHBondContact O-N 3.28Å; M322-I336 HydrophobicContact CB-CG2 4.34Å; M322-I336 HydrophobicContact CG-CD1 3.97Å; M322-I336 HydrophobicContact CG-CG1 4.22Å; M322-I336 HydrophobicContact CG-CG2 4.15Å; M322-I336 HydrophobicContact SD-CD1 3.82Å; M322-I336 HydrophobicContact SD-CG2 4.19Å
337	D	93.7	Very high	94.4	Very high	39 Å²	39	49.2 Å²	49.2	21%	0.209	26%	0.257	C	S	.	.			trans	61.1	66.4	173	-162.3	23.6	0	0	0	116.5	K219 G339	K219-D337 IonicContact NZ-OD1 2.64Å; K219-D337 PolarHBondContact NZ-OD1 3.41Å; D337-G339 PolarHBondContact O-N 2.76Å; D337-G339 PolarHBondContact OD1-N 3.43Å
338	F	94.6	Very high	94.3	Very high	3 Å²	3	47.6 Å²	47.6	1%	0.013	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-67.8	12.7	166.9	-63.7	-82.2	0	0	0	114.1	I237 L238 L241 F251 V252 L306 H313 S340 A341	I237-F338 HydrophobicContact CG2-CB 4.18Å; I237-F338 HydrophobicContact CG2-CD1 4.13Å; I237-F338 HydrophobicContact CG2-CG 4.33Å; L238-F338 HydrophobicContact CD2-CB 4.38Å; L238-F338 HydrophobicContact CD2-CD2 3.83Å; L238-F338 HydrophobicContact CD2-CG 4.39Å; L241-F338 HydrophobicContact CD1-CD1 3.83Å; L241-F338 HydrophobicContact CD1-CD2 3.89Å; L241-F338 HydrophobicContact CD1-CE1 3.58Å; L241-F338 HydrophobicContact CD1-CE2 3.65Å; L241-F338 HydrophobicContact CD1-CG 3.98Å; L241-F338 HydrophobicContact CD1-CZ 3.5Å; F251-F338 HydrophobicContact CB-CE2 4.2Å; F251-F338 HydrophobicContact CB-CZ 3.9Å; V252-F338 HydrophobicContact CG1-CE2 4.25Å; L306-F338 HydrophobicContact CD1-CE1 3.94Å; L306-F338 HydrophobicContact CD2-CE1 3.77Å; L306-F338 HydrophobicContact CD2-CZ 4.34Å; H313-F338 AromaticContact CD2-CD1 3.76Å; H313-F338 AromaticContact CD2-CE1 3.58Å; F338-S340 PolarHBondContact O-N 2.59Å; F338-A341 HydrophobicContact CB-CB 4.02Å; F338-A341 HydrophobicContact CD1-CB 3.97Å; F338-A341 VanDerWaalsContact O-CB 3.31Å; F338-A341 WeakPolarHBondContact O-CB 3.28Å; F338-A341 PolarHBondContact O-N 3.27Å
339	G	91	Very high	94	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-63.2	-21.9	179.3	0	0	0	0	0	114.7	Q230 E234 D337	Q230-G339 VanDerWaalsContact CG-O 3.29Å; Q230-G339 WeakPolarHBondContact CG-O 3.32Å; Q230-G339 PolarHBondContact NE2-O 2.8Å; E234-G339 WeakPolarHBondContact OE2-CA 3.42Å; D337-G339 PolarHBondContact O-N 2.76Å; D337-G339 PolarHBondContact OD1-N 3.43Å
340	S	92.5	Very high	93.8	Very high	25 Å²	25	41.1 Å²	41.1	18%	0.175	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-101.5	-4	172.4	-60.6	0	0	0	0	113.8	F338	F338-S340 PolarHBondContact O-N 2.59Å
341	A	95.1	Very high	93.6	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.008	23%	0.233	C	C	.	.			trans	-70.9	155.2	-169.4	0	0	0	0	0	112.7	I233 I237 I312 H313 F338	I233-A341 WeakPolarHBondContact CG2-O 3.41Å; I237-A341 HydrophobicContact CD1-CB 3.67Å; I237-A341 WeakPolarHBondContact CD1-O 3.2Å; I237-A341 HydrophobicContact CG2-CB 4.36Å; I312-A341 VanDerWaalsContact O-CA 3.24Å; I312-A341 WeakPolarHBondContact O-CA 3.5Å; I312-A341 WeakPolarHBondContact O-CB 3.49Å; H313-A341 WeakPolarHBondContact O-CA 3.32Å; F338-A341 HydrophobicContact CB-CB 4.02Å; F338-A341 HydrophobicContact CD1-CB 3.97Å; F338-A341 VanDerWaalsContact O-CB 3.31Å; F338-A341 WeakPolarHBondContact O-CB 3.28Å; F338-A341 PolarHBondContact O-N 3.27Å
342	S	94.5	Very high	93.3	Very high	23 Å²	23	44 Å²	44	16%	0.161	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	162.5	-179.9	61.9	0	0	0	0	112.3	L311 I312	L311-S342 WeakPolarHBondContact CA-O 3.42Å; I312-S342 PolarHBondContact N-O 2.95Å; I312-S342 PolarHBondContact O-N 3.37Å
343	H	95.1	Very high	93.2	Very high	57 Å²	57	43.5 Å²	43.5	26%	0.264	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	140.9	167.3	-166.4	-115.1	0	0	0	109.4	R240 L309 G310 S345 K346	R240-H343 PolarHBondContact NH1-CD2 3.01Å; R240-H343 VanDerWaalsContact NH1-CD2 3.27Å; R240-H343 PolarHBondContact NH1-NE2 3.44Å; L309-H343 PolarHBondContact O-NE2 2.74Å; G310-H343 CarbonylContact O-C 3.59Å; G310-H343 WeakPolarHBondContact O-CA 3.2Å; G310-H343 PolarHBondContact O-CD2 3.45Å; H343-S345 PolarHBondContact ND1-OG 2.96Å; H343-S345 PolarHBondContact O-N 2.82Å; H343-S345 VanDerWaalsContact O-N 3.13Å; H343-K346 WeakPolarHBondContact O-CA 3.48Å; H343-K346 WeakPolarHBondContact O-CB 3.48Å; H343-K346 PolarHBondContact O-N 3.02Å
344	V	95.3	Very high	93.1	Very high	50 Å²	50	44 Å²	44	30%	0.303	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-56.2	-33.2	-177.5	65.6	0	0	0	0	112.9	G310 I312 K346 A347 C370	G310-V344 PolarHBondContact O-N 3.27Å; I312-V344 HydrophobicContact CD1-CB 4.32Å; I312-V344 HydrophobicContact CD1-CG2 4.38Å; I312-V344 HydrophobicContact CG1-CB 4.44Å; V344-K346 PolarHBondContact O-N 3.28Å; V344-K346 VanDerWaalsContact O-N 3.1Å; V344-A347 VanDerWaalsContact O-CB 3.3Å; V344-A347 WeakPolarHBondContact O-CB 3.48Å; V344-A347 PolarHBondContact O-N 3.47Å; V344-A347 VanDerWaalsContact O-N 3.1Å; V344-C370 HydrophobicContact CG2-CB 4.04Å
345	S	93.6	Very high	93	Very high	95 Å²	95	45.6 Å²	45.6	66%	0.664	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-71.4	1.3	174.3	79.3	0	0	0	0	115	H343	H343-S345 PolarHBondContact ND1-OG 2.96Å; H343-S345 PolarHBondContact O-N 2.82Å; H343-S345 VanDerWaalsContact O-N 3.13Å
346	K	91.4	Very high	93	Very high	140 Å²	140	48.7 Å²	48.7	61%	0.609	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-117.6	5.9	173.7	-60.2	-177.7	179.3	178.3	0	111.8	H343 V344	H343-K346 WeakPolarHBondContact O-CA 3.48Å; H343-K346 WeakPolarHBondContact O-CB 3.48Å; H343-K346 PolarHBondContact O-N 3.02Å; V344-K346 PolarHBondContact O-N 3.28Å; V344-K346 VanDerWaalsContact O-N 3.1Å
347	A	90.3	Very high	93.1	Very high	35 Å²	35	51.5 Å²	51.5	29%	0.289	28%	0.282	S	S	.	.			trans	-67.2	130.9	174.6	0	0	0	0	0	110.3	I312 V344 F369	I312-A347 HydrophobicContact CD1-CB 4.25Å; V344-A347 VanDerWaalsContact O-CB 3.3Å; V344-A347 WeakPolarHBondContact O-CB 3.48Å; V344-A347 PolarHBondContact O-N 3.47Å; V344-A347 VanDerWaalsContact O-N 3.1Å; A347-F369 HydrophobicContact CB-CD2 4.32Å; A347-F369 HydrophobicContact CB-CE1 4.37Å; A347-F369 HydrophobicContact CB-CE2 3.7Å; A347-F369 HydrophobicContact CB-CZ 3.73Å
348	V	89.4	Confident	93.3	Very high	95 Å²	95	50.1 Å²	50.1	58%	0.576	27%	0.274	S	S	*	.			trans	-120.9	123.1	-180	178.3	0	0	0	0	108.9	T351 F369	V348-T351 WeakPolarHBondContact O-CB 3.2Å; V348-T351 PolarHBondContact O-N 3.44Å; V348-T351 PolarHBondContact O-OG1 3.35Å; V348-F369 WeakPolarHBondContact O-CE1 3.25Å
349	C	86.7	Confident	93.5	Very high	61 Å²	61	50 Å²	50	41%	0.412	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	152.7	179.8	-56.7	0	0	0	0	112.2	T351	C349-T351 PolarHBondContact O-N 2.83Å; C349-T351 VanDerWaalsContact O-N 3.17Å
350	S	87.6	Confident	93.9	Very high	57 Å²	57	50 Å²	50	40%	0.399	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	3.6	-178.9	-35.2	0	0	0	0	116.4	T420	S350-T420 PolarHBondContact OG-OG1 3.41Å
351	T	88.4	Confident	94.2	Very high	53 Å²	53	48.9 Å²	48.9	33%	0.325	27%	0.265	S	S	.	.			trans	-67.8	140	175.7	-54.8	0	0	0	0	111.5	V348 C349 L353	V348-T351 WeakPolarHBondContact O-CB 3.2Å; V348-T351 PolarHBondContact O-N 3.44Å; V348-T351 PolarHBondContact O-OG1 3.35Å; C349-T351 PolarHBondContact O-N 2.83Å; C349-T351 VanDerWaalsContact O-N 3.17Å; T351-L353 HydrophobicContact CG2-CD1 4.47Å; T351-L353 HydrophobicContact CG2-CD2 3.95Å; T351-L353 HydrophobicContact CG2-CG 3.92Å; T351-L353 PolarHBondContact O-N 3.34Å
352	Y	90.9	Very high	94.3	Very high	112 Å²	112	49.1 Å²	49.1	44%	0.439	27%	0.266	S	S	.	.			trans	-80.5	100.1	176	-170.8	-90.8	0	0	0	110.2	R359 E397	Y352-R359 VanDerWaalsContact CE1-NH2 3.33Å; Y352-R359 PolarHBondContact OH-NH2 2.96Å; Y352-E397 HydrophobicContact CE2-CG 4.48Å
353	L	94.1	Very high	94.5	Very high	35 Å²	35	48.1 Å²	48.1	18%	0.183	26%	0.259	C	S	.	.			trans	-123.6	167.9	-179.4	-62.3	177.7	0	0	0	111.4	A314 T351 R359 I363 F369	A314-L353 HydrophobicContact CB-CD1 4.38Å; T351-L353 HydrophobicContact CG2-CD1 4.47Å; T351-L353 HydrophobicContact CG2-CD2 3.95Å; T351-L353 HydrophobicContact CG2-CG 3.92Å; T351-L353 PolarHBondContact O-N 3.34Å; L353-R359 PolarHBondContact O-NE 3.27Å; L353-R359 PolarHBondContact O-NH2 2.96Å; L353-I363 HydrophobicContact CB-CG2 4.29Å; L353-F369 HydrophobicContact CD1-CE1 4.25Å; L353-F369 HydrophobicContact CD1-CE2 3.68Å; L353-F369 HydrophobicContact CD1-CZ 3.38Å
354	Q	97.3	Very high	94.7	Very high	12 Å²	12	45.4 Å²	45.4	6%	0.056	25%	0.247	C	C	.	.	S	Bend	trans	62.4	139.8	-179.1	-53.9	170	-68.7	0	0	115	A314 R356 Y358 R359 I373 S377	A314-Q354 WeakPolarHBondContact O-CA 3.4Å; A314-Q354 VanDerWaalsContact O-CG 3.25Å; A314-Q354 WeakPolarHBondContact O-CG 3.31Å; A314-Q354 PolarHBondContact O-N 3.01Å; Q354-R356 PolarHBondContact O-N 3.45Å; Q354-Y358 PolarHBondContact NE2-O 3.46Å; Q354-R359 HydrophobicContact CB-CB 4.06Å; Q354-R359 HydrophobicContact CB-CG 4.28Å; Q354-R359 PolarHBondContact O-NE 3.21Å; Q354-R359 PolarHBondContact O-NH2 3.16Å; Q354-I373 HydrophobicContact CG-CD1 4.14Å; Q354-I373 PolarHBondContact NE2-O 3.33Å; Q354-S377 PolarHBondContact NE2-OG 3.23Å
355	S	96.9	Very high	94.8	Very high	33 Å²	33	43.1 Å²	43.1	23%	0.231	23%	0.232	C	C	.	.			trans	-59	132.7	165.9	-66.7	0	0	0	0	110.2	D315 K317 Y357 Y358 R359	D315-S355 WeakPolarHBondContact OD1-CB 3.43Å; D315-S355 PolarHBondContact OD1-N 2.95Å; D315-S355 PolarHBondContact OD1-OG 3.16Å; K317-S355 WeakPolarHBondContact CD-OG 3.47Å; K317-S355 PolarHBondContact NZ-OG 3.15Å; S355-Y357 VanDerWaalsContact C-N 3.33Å; S355-Y357 PolarHBondContact O-N 2.94Å; S355-Y357 VanDerWaalsContact O-N 3.08Å; S355-Y358 PolarHBondContact O-N 2.87Å; S355-R359 PolarHBondContact O-N 3.4Å
356	R	97.9	Very high	95	Very high	65 Å²	65	38.6 Å²	38.6	25%	0.245	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-51.6	-42.5	-156.5	-168.6	-178.8	-71.1	141.5	-2.5	114.6	Q354 Y358 R359 G394 A395 Q400 D911	Q354-R356 PolarHBondContact O-N 3.45Å; R356-Y358 VanDerWaalsContact C-N 3.27Å; R356-Y358 PolarHBondContact O-N 3.25Å; R356-R359 VanDerWaalsContact O-CB 3.27Å; R356-R359 WeakPolarHBondContact O-CB 3.42Å; R356-R359 PolarHBondContact O-N 3.38Å; R356-G394 WeakPolarHBondContact CD-O 3.04Å; R356-A395 PolarHBondContact NH1-O 3.07Å; R356-Q400 PolarHBondContact O-NE2 3.44Å; R356-Q400 PolarHBondContact O-OE1 3.1Å; R356-D911 IonicContact NH2-OD1 2.9Å; R356-D911 PolarHBondContact NH2-OD1 3.13Å
357	Y	98.6	Very high	95.3	Very high	91 Å²	91	32.8 Å²	32.8	36%	0.357	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-68.8	-24.6	-176.2	-54	-18.7	0	0	0	113.9	S355 P390 Y392 P393 G394 Q400	S355-Y357 VanDerWaalsContact C-N 3.33Å; S355-Y357 PolarHBondContact O-N 2.94Å; S355-Y357 VanDerWaalsContact O-N 3.08Å; Y357-P390 HydrophobicContact CD2-CB 4.11Å; Y357-P390 HydrophobicContact CD2-CG 4.11Å; Y357-P390 HydrophobicContact CE2-CG 4.42Å; Y357-Y392 WeakPolarHBondContact CA-O 3.21Å; Y357-Y392 WeakPolarHBondContact CB-O 3.46Å; Y357-P393 VanDerWaalsContact CD1-CA 3.45Å; Y357-P393 HydrophobicContact CD1-CB 4.44Å; Y357-P393 VanDerWaalsContact CE1-C 3.44Å; Y357-P393 HydrophobicContact CE1-CB 4.24Å; Y357-P393 HydrophobicContact CE2-CB 4.37Å; Y357-G394 WeakPolarHBondContact CE1-O 3.43Å; Y357-Q400 PolarHBondContact O-NE2 3.31Å; Y357-Q400 VanDerWaalsContact O-NE2 3.13Å
358	Y	98.8	Very high	95.6	Very high	9 Å²	9	35.6 Å²	35.6	4%	0.035	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-105.7	9.6	-177.9	-38	-79.7	0	0	0	111.8	K317 P318 Q354 S355 R356 S377 C380 V381 E384	K317-Y358 HydrophobicContact CB-CD2 3.52Å; K317-Y358 HydrophobicContact CB-CE2 3.45Å; K317-Y358 VanDerWaalsContact CB-CE2 3.45Å; K317-Y358 HydrophobicContact CB-CG 4.13Å; K317-Y358 HydrophobicContact CD-CE2 4.48Å; P318-Y358 VanDerWaalsContact CD-CE1 3.5Å; P318-Y358 WeakPolarHBondContact CD-OH 3.32Å; P318-Y358 HydrophobicContact CG-CE1 4.06Å; Q354-Y358 PolarHBondContact NE2-O 3.46Å; S355-Y358 PolarHBondContact O-N 2.87Å; R356-Y358 VanDerWaalsContact C-N 3.27Å; R356-Y358 PolarHBondContact O-N 3.25Å; Y358-S377 WeakPolarHBondContact O-CA 3.42Å; Y358-S377 PolarHBondContact O-OG 3.19Å; Y358-C380 HydrophobicContact CD1-CB 3.79Å; Y358-V381 HydrophobicContact CD1-CG2 4.17Å; Y358-V381 HydrophobicContact CE1-CG2 4.42Å; Y358-E384 WeakPolarHBondContact CE1-OE2 3.35Å; Y358-E384 PolarHBondContact OH-OE2 3.04Å
359	R	98.7	Very high	96	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.008	17%	0.169	C	C	.	.			trans	-76.9	133.5	-176.8	-176.1	178.5	-68.2	156.1	12.7	111.9	Y352 L353 Q354 S355 R356 I363 I364 W376 E397	Y352-R359 VanDerWaalsContact CE1-NH2 3.33Å; Y352-R359 PolarHBondContact OH-NH2 2.96Å; L353-R359 PolarHBondContact O-NE 3.27Å; L353-R359 PolarHBondContact O-NH2 2.96Å; Q354-R359 HydrophobicContact CB-CB 4.06Å; Q354-R359 HydrophobicContact CB-CG 4.28Å; Q354-R359 PolarHBondContact O-NE 3.21Å; Q354-R359 PolarHBondContact O-NH2 3.16Å; S355-R359 PolarHBondContact O-N 3.4Å; R356-R359 VanDerWaalsContact O-CB 3.27Å; R356-R359 WeakPolarHBondContact O-CB 3.42Å; R356-R359 PolarHBondContact O-N 3.38Å; R359-I363 HydrophobicContact CG-CB 3.81Å; R359-I363 HydrophobicContact CG-CG2 3.86Å; R359-I364 HydrophobicContact CG-CG1 3.88Å; R359-W376 PolarHBondContact O-NE1 3.42Å; R359-E397 IonicContact CZ-OE1 2.85Å; R359-E397 IonicContact NH1-OE1 3.65Å; R359-E397 PolarHBondContact NH1-OE1 3.5Å
360	A	98.8	Very high	96.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.161	C	C	.	.			trans	-77.2	148.9	-178.7	0	0	0	0	0	112.5	E362 I363 I364 I373 W376	A360-E362 HydrophobicContact CB-CG 4.2Å; A360-E362 WeakPolarHBondContact CB-OE2 3.47Å; A360-E362 PolarHBondContact O-N 3.24Å; A360-I363 PolarHBondContact O-N 3.4Å; A360-I364 PolarHBondContact O-N 3.1Å; A360-I373 HydrophobicContact CB-CB 3.99Å; A360-I373 HydrophobicContact CB-CG2 4.06Å; A360-W376 HydrophobicContact CB-CB 3.8Å; A360-W376 HydrophobicContact CB-CD2 4.41Å; A360-W376 HydrophobicContact CB-CG 3.78Å
361	P	98.6	Very high	97	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	15%	0.146	C	C	.	.	H	α-helix	trans	-54.1	-36.9	-179.2	-28.5	36.2	0	0	0	113.8	I363 I364 L365 W376 I401 I404 I501	P361-I363 VanDerWaalsContact C-N 3.32Å; P361-I363 PolarHBondContact O-N 2.87Å; P361-I364 PolarHBondContact O-N 3.06Å; P361-I364 VanDerWaalsContact O-N 3.16Å; P361-L365 WeakPolarHBondContact O-CB 3.47Å; P361-L365 VanDerWaalsContact O-CG 3.31Å; P361-L365 WeakPolarHBondContact O-CG 3.21Å; P361-L365 PolarHBondContact O-N 2.78Å; P361-W376 VanDerWaalsContact CD-CE3 3.48Å; P361-W376 HydrophobicContact CG-CD2 4.39Å; P361-W376 HydrophobicContact CG-CE3 4.01Å; P361-W376 HydrophobicContact CG-CH2 3.62Å; P361-W376 HydrophobicContact CG-CZ2 4.01Å; P361-W376 HydrophobicContact CG-CZ3 3.59Å; P361-I401 HydrophobicContact CB-CD1 4.4Å; P361-I404 HydrophobicContact CG-CD1 4.47Å; P361-I501 HydrophobicContact CB-CG2 3.95Å; P361-I501 HydrophobicContact CG-CB 4.47Å; P361-I501 HydrophobicContact CG-CG1 4.5Å; P361-I501 HydrophobicContact CG-CG2 4.04Å
362	E	98.5	Very high	97.5	Very high	5 Å²	5	27.4 Å²	27.4	2%	0.023	14%	0.137	C	C	.	.	H	α-helix	trans	-60.8	-36.7	177.1	57	-91.7	-140.4	0	0	113.2	A360 G366 L367 F369 I373 A503 R506	A360-E362 HydrophobicContact CB-CG 4.2Å; A360-E362 WeakPolarHBondContact CB-OE2 3.47Å; A360-E362 PolarHBondContact O-N 3.24Å; E362-G366 CarbonylContact O-C 3.15Å; E362-G366 WeakPolarHBondContact O-CA 3.32Å; E362-G366 PolarHBondContact O-N 3.49Å; E362-L367 HydrophobicContact CB-CB 3.89Å; E362-L367 HydrophobicContact CB-CD1 4.35Å; E362-L367 PolarHBondContact O-N 2.84Å; E362-F369 HydrophobicContact CG-CB 3.84Å; E362-I373 HydrophobicContact CG-CG2 3.85Å; E362-I373 WeakPolarHBondContact OE1-CG2 3.47Å; E362-A503 WeakPolarHBondContact OE1-CB 3.41Å; E362-R506 IonicContact OE1-CZ 2.73Å; E362-R506 IonicContact OE1-NH1 3.43Å; E362-R506 PolarHBondContact OE1-NH1 3.35Å; E362-R506 IonicContact OE1-NH2 3.31Å; E362-R506 PolarHBondContact OE1-NH2 2.98Å; E362-R506 IonicContact OE2-CZ 3.5Å; E362-R506 IonicContact OE2-NH1 2.66Å; E362-R506 PolarHBondContact OE2-NH1 2.71Å; E362-R506 IonicContact OE2-NH2 2.67Å; E362-R506 PolarHBondContact OE2-NH2 3.37Å
363	I	98.5	Very high	97.9	Very high	3 Å²	3	22 Å²	22	2%	0.015	12%	0.116	C	C	.	.	H	α-helix	trans	-73.3	-35.3	175.5	-55.7	-55.8	0	0	0	110.9	L353 R359 A360 P361 F369 I373 K421	L353-I363 HydrophobicContact CB-CG2 4.29Å; R359-I363 HydrophobicContact CG-CB 3.81Å; R359-I363 HydrophobicContact CG-CG2 3.86Å; A360-I363 PolarHBondContact O-N 3.4Å; P361-I363 VanDerWaalsContact C-N 3.32Å; P361-I363 PolarHBondContact O-N 2.87Å; I363-F369 HydrophobicContact CD1-CB 3.9Å; I363-F369 HydrophobicContact CD1-CD1 3.37Å; I363-F369 HydrophobicContact CD1-CD2 3.91Å; I363-F369 HydrophobicContact CD1-CE1 3.78Å; I363-F369 HydrophobicContact CD1-CE2 4.28Å; I363-F369 HydrophobicContact CD1-CG 3.45Å; I363-F369 VanDerWaalsContact CD1-CG 3.45Å; I363-F369 HydrophobicContact CD1-CZ 4.23Å; I363-I373 HydrophobicContact CD1-CD1 4.34Å; I363-I373 HydrophobicContact CD1-CG2 4.11Å; I363-I373 HydrophobicContact CG1-CD1 4.44Å; I363-I373 HydrophobicContact CG1-CG2 4.05Å; I363-K421 PolarHBondContact O-NZ 2.72Å
364	I	98.5	Very high	98.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-68.1	-49	176.1	-54.9	167.9	0	0	0	110.1	R359 A360 P361 G366 E397 Q400 I401 I404 K421 F425	R359-I364 HydrophobicContact CG-CG1 3.88Å; A360-I364 PolarHBondContact O-N 3.1Å; P361-I364 PolarHBondContact O-N 3.06Å; P361-I364 VanDerWaalsContact O-N 3.16Å; I364-G366 VanDerWaalsContact C-N 3.31Å; I364-G366 PolarHBondContact O-N 3.17Å; I364-E397 HydrophobicContact CG2-CB 4.33Å; I364-Q400 HydrophobicContact CD1-CB 4.08Å; I364-Q400 HydrophobicContact CD1-CG 3.59Å; I364-I401 HydrophobicContact CD1-CB 4.47Å; I364-I401 HydrophobicContact CD1-CD1 4.46Å; I364-I401 HydrophobicContact CG2-CB 4.06Å; I364-I401 HydrophobicContact CG2-CG2 4.44Å; I364-I404 HydrophobicContact CD1-CD1 4.06Å; I364-K421 WeakPolarHBondContact O-CB 3.37Å; I364-K421 VanDerWaalsContact O-CD 3.27Å; I364-K421 WeakPolarHBondContact O-CD 3.43Å; I364-K421 WeakPolarHBondContact O-CE 3.37Å; I364-K421 PolarHBondContact O-NZ 2.87Å; I364-F425 HydrophobicContact CG2-CD2 4.34Å; I364-F425 HydrophobicContact CG2-CE2 3.74Å; I364-F425 HydrophobicContact CG2-CZ 3.93Å; I364-F425 WeakPolarHBondContact O-CE2 3.16Å
365	L	98.2	Very high	98.2	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-74.5	-14.9	179.8	-63.8	175.6	0	0	0	113.8	P361 L367 P411 L416 G419 T420 K421 F426	P361-L365 WeakPolarHBondContact O-CB 3.47Å; P361-L365 VanDerWaalsContact O-CG 3.31Å; P361-L365 WeakPolarHBondContact O-CG 3.21Å; P361-L365 PolarHBondContact O-N 2.78Å; L365-L367 HydrophobicContact CB-CD1 4.2Å; L365-L367 HydrophobicContact CB-CG 4.19Å; L365-L367 HydrophobicContact CD1-CD1 4.13Å; L365-P411 HydrophobicContact CD1-CB 4.21Å; L365-P411 HydrophobicContact CD1-CG 4.36Å; L365-L416 HydrophobicContact CD1-CD2 4.16Å; L365-L416 HydrophobicContact CD2-CD2 3.91Å; L365-G419 CarbonylContact O-C 3.5Å; L365-G419 WeakPolarHBondContact O-CA 3.38Å; L365-T420 PolarHBondContact O-N 3.23Å; L365-T420 VanDerWaalsContact O-N 3.08Å; L365-K421 WeakPolarHBondContact O-CB 3.44Å; L365-K421 PolarHBondContact O-N 2.73Å; L365-F426 HydrophobicContact CD2-CD2 4.31Å; L365-F426 HydrophobicContact CD2-CE2 3.76Å
366	G	97.6	Very high	98.3	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.01	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	78	25.2	179.1	0	0	0	0	0	114.3	E362 I364 T420	E362-G366 CarbonylContact O-C 3.15Å; E362-G366 WeakPolarHBondContact O-CA 3.32Å; E362-G366 PolarHBondContact O-N 3.49Å; I364-G366 VanDerWaalsContact C-N 3.31Å; I364-G366 PolarHBondContact O-N 3.17Å; G366-T420 WeakPolarHBondContact CA-OG1 3.45Å; G366-T420 PolarHBondContact O-OG1 3.24Å; G366-T420 VanDerWaalsContact O-OG1 3.08Å
367	L	97.8	Very high	98.3	Very high	17 Å²	17	15.4 Å²	15.4	9%	0.089	8%	0.083	C	C	.	.			trans	-72.6	167.9	175.5	-71.6	168.7	0	0	0	111.9	E362 L365 L415 A418	E362-L367 HydrophobicContact CB-CB 3.89Å; E362-L367 HydrophobicContact CB-CD1 4.35Å; E362-L367 PolarHBondContact O-N 2.84Å; L365-L367 HydrophobicContact CB-CD1 4.2Å; L365-L367 HydrophobicContact CB-CG 4.19Å; L365-L367 HydrophobicContact CD1-CD1 4.13Å; L367-L415 HydrophobicContact CD1-CB 4.14Å; L367-L415 HydrophobicContact CD1-CD2 4.13Å; L367-A418 VanDerWaalsContact CD2-C 3.48Å; L367-A418 HydrophobicContact CD2-CB 3.61Å
368	P	96.7	Very high	98.4	Very high	95 Å²	95	11.1 Å²	11.1	62%	0.617	7%	0.067	S	C	*	.			trans	-56.9	150	159.7	-20.5	33.3	0	0	0	111.4
369	F	97.8	Very high	98.4	Very high	22 Å²	22	10.7 Å²	10.7	10%	0.096	7%	0.065	C	C	.	.			trans	-148.9	164.9	-178.1	68.2	-92.3	0	0	0	112.3	I312 A347 V348 L353 E362 I363 I373	I312-F369 HydrophobicContact CD1-CD2 4.04Å; I312-F369 HydrophobicContact CD1-CE2 3.85Å; A347-F369 HydrophobicContact CB-CD2 4.32Å; A347-F369 HydrophobicContact CB-CE1 4.37Å; A347-F369 HydrophobicContact CB-CE2 3.7Å; A347-F369 HydrophobicContact CB-CZ 3.73Å; V348-F369 WeakPolarHBondContact O-CE1 3.25Å; L353-F369 HydrophobicContact CD1-CE1 4.25Å; L353-F369 HydrophobicContact CD1-CE2 3.68Å; L353-F369 HydrophobicContact CD1-CZ 3.38Å; E362-F369 HydrophobicContact CG-CB 3.84Å; I363-F369 HydrophobicContact CD1-CB 3.9Å; I363-F369 HydrophobicContact CD1-CD1 3.37Å; I363-F369 HydrophobicContact CD1-CD2 3.91Å; I363-F369 HydrophobicContact CD1-CE1 3.78Å; I363-F369 HydrophobicContact CD1-CE2 4.28Å; I363-F369 HydrophobicContact CD1-CG 3.45Å; I363-F369 VanDerWaalsContact CD1-CG 3.45Å; I363-F369 HydrophobicContact CD1-CZ 4.23Å; F369-I373 HydrophobicContact CB-CG2 3.78Å; F369-I373 HydrophobicContact CD2-CD1 4.05Å; F369-I373 HydrophobicContact CD2-CG2 4.15Å; F369-I373 HydrophobicContact CE2-CD1 4.29Å; F369-I373 HydrophobicContact CG-CG2 4.28Å
370	C	97	Very high	98.4	Very high	35 Å²	35	10.8 Å²	10.8	24%	0.236	7%	0.066	C	C	.	.			trans	-144.4	-159.7	178.5	65.8	0	0	0	0	110.1	V344 A372 I373	V344-C370 HydrophobicContact CG2-CB 4.04Å; C370-A372 PolarHBondContact O-N 2.85Å; C370-A372 VanDerWaalsContact SG-CB 3.57Å; C370-I373 PolarHBondContact O-N 3.35Å
371	E	98.1	Very high	98.4	Very high	20 Å²	20	10.8 Å²	10.8	9%	0.093	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-9.2	177.3	-35.7	85.2	146.2	0	0	112.8	K307 L311 I312 I373 D374	K307-E371 HydrophobicContact CB-CB 4.35Å; K307-E371 HydrophobicContact CB-CG 4.29Å; K307-E371 HydrophobicContact CD-CB 4.29Å; K307-E371 HydrophobicContact CG-CB 4.4Å; K307-E371 HydrophobicContact CG-CG 4.19Å; K307-E371 IonicContact NZ-OE1 2.78Å; K307-E371 PolarHBondContact NZ-OE1 2.98Å; K307-E371 IonicContact NZ-OE2 2.74Å; K307-E371 PolarHBondContact NZ-OE2 3.17Å; L311-E371 WeakPolarHBondContact O-CG 3.35Å; I312-E371 HydrophobicContact CG1-CB 4.45Å; I312-E371 HydrophobicContact CG1-CG 4.01Å; E371-I373 PolarHBondContact O-N 3.25Å; E371-D374 PolarHBondContact O-N 3.32Å
372	A	98.6	Very high	98.4	Very high	16 Å²	16	10.8 Å²	10.8	13%	0.132	7%	0.066	C	C	.	.	H	α-helix	trans	-60.9	-21.6	172.8	0	0	0	0	0	113.5	C370 D374 M375 W376 A503 R506	C370-A372 PolarHBondContact O-N 2.85Å; C370-A372 VanDerWaalsContact SG-CB 3.57Å; A372-D374 VanDerWaalsContact C-N 3.28Å; A372-D374 PolarHBondContact O-N 3.48Å; A372-M375 PolarHBondContact O-N 3.47Å; A372-W376 PolarHBondContact O-N 2.83Å; A372-A503 HydrophobicContact CB-CB 4.19Å; A372-R506 WeakPolarHBondContact O-CD 3.1Å; A372-R506 PolarHBondContact O-NH1 2.85Å
373	I	98.8	Very high	98.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-64.8	-34.2	176.7	72.8	176.5	0	0	0	111.7	I312 A314 Q354 A360 E362 I363 F369 C370 E371 M375 W376 S377	I312-I373 HydrophobicContact CG2-CD1 3.6Å; I312-I373 HydrophobicContact CG2-CG1 3.69Å; A314-I373 HydrophobicContact CB-CD1 4.2Å; Q354-I373 HydrophobicContact CG-CD1 4.14Å; Q354-I373 PolarHBondContact NE2-O 3.33Å; A360-I373 HydrophobicContact CB-CB 3.99Å; A360-I373 HydrophobicContact CB-CG2 4.06Å; E362-I373 HydrophobicContact CG-CG2 3.85Å; E362-I373 WeakPolarHBondContact OE1-CG2 3.47Å; I363-I373 HydrophobicContact CD1-CD1 4.34Å; I363-I373 HydrophobicContact CD1-CG2 4.11Å; I363-I373 HydrophobicContact CG1-CD1 4.44Å; I363-I373 HydrophobicContact CG1-CG2 4.05Å; F369-I373 HydrophobicContact CB-CG2 3.78Å; F369-I373 HydrophobicContact CD2-CD1 4.05Å; F369-I373 HydrophobicContact CD2-CG2 4.15Å; F369-I373 HydrophobicContact CE2-CD1 4.29Å; F369-I373 HydrophobicContact CG-CG2 4.28Å; C370-I373 PolarHBondContact O-N 3.35Å; E371-I373 PolarHBondContact O-N 3.25Å; I373-M375 VanDerWaalsContact C-N 3.32Å; I373-M375 PolarHBondContact O-N 3.02Å; I373-W376 WeakPolarHBondContact O-CB 3.49Å; I373-W376 PolarHBondContact O-N 2.86Å; I373-S377 PolarHBondContact O-N 3.13Å; I373-S377 VanDerWaalsContact O-N 3.1Å; I373-S377 PolarHBondContact O-OG 3.03Å
374	D	98.9	Very high	98.4	Very high	3 Å²	3	10.5 Å²	10.5	2%	0.016	7%	0.065	C	C	.	.	H	α-helix	trans	-72.8	-28.6	-179.4	-58.1	-44.1	0	0	0	111.4	L303 I312 H313 A314 E371 A372 S377 L378	L303-D374 HydrophobicContact CD1-CB 3.97Å; L303-D374 HydrophobicContact CD2-CB 3.81Å; I312-D374 WeakPolarHBondContact CG2-OD2 3.14Å; H313-D374 WeakPolarHBondContact CB-OD1 3.42Å; H313-D374 PolarHBondContact N-OD2 2.84Å; A314-D374 PolarHBondContact N-OD1 3.15Å; E371-D374 PolarHBondContact O-N 3.32Å; A372-D374 VanDerWaalsContact C-N 3.28Å; A372-D374 PolarHBondContact O-N 3.48Å; D374-S377 PolarHBondContact O-N 3.37Å; D374-L378 WeakPolarHBondContact O-CB 3.33Å; D374-L378 PolarHBondContact O-N 2.89Å
375	M	98.9	Very high	98.4	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.01	7%	0.065	C	C	.	.	H	α-helix	trans	-69.5	-32.2	172.2	-71.8	-57.8	-57.5	0	0	112.7	L303 A372 I373 L378 G379 M498 I507 P509 T512	L303-M375 HydrophobicContact CB-SD 4.47Å; L303-M375 HydrophobicContact CD1-SD 3.71Å; A372-M375 PolarHBondContact O-N 3.47Å; I373-M375 VanDerWaalsContact C-N 3.32Å; I373-M375 PolarHBondContact O-N 3.02Å; M375-L378 HydrophobicContact CE-CD2 4.33Å; M375-L378 HydrophobicContact SD-CD2 4.25Å; M375-G379 PolarHBondContact O-N 3.45Å; M375-G379 VanDerWaalsContact O-N 3.13Å; M375-M498 HydrophobicContact CE-CE 4.11Å; M375-M498 HydrophobicContact CE-CG 4.16Å; M375-I507 HydrophobicContact CE-CG2 4.02Å; M375-I507 WeakPolarHBondContact CG-O 3.41Å; M375-P509 HydrophobicContact CG-CG 4.14Å; M375-P509 HydrophobicContact SD-CB 4.07Å; M375-P509 HydrophobicContact SD-CG 3.58Å; M375-P509 VanDerWaalsContact SD-CG 3.58Å; M375-T512 HydrophobicContact CE-CG2 4.47Å; M375-T512 WeakPolarHBondContact CE-OG1 3.08Å
376	W	98.9	Very high	98.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-66.9	-47.5	169.8	175.4	-78.8	0	0	0	110.7	R359 A360 P361 A372 I373 L378 G379 C380 Y392 I404 L499 I501	R359-W376 PolarHBondContact O-NE1 3.42Å; A360-W376 HydrophobicContact CB-CB 3.8Å; A360-W376 HydrophobicContact CB-CD2 4.41Å; A360-W376 HydrophobicContact CB-CG 3.78Å; P361-W376 VanDerWaalsContact CD-CE3 3.48Å; P361-W376 HydrophobicContact CG-CD2 4.39Å; P361-W376 HydrophobicContact CG-CE3 4.01Å; P361-W376 HydrophobicContact CG-CH2 3.62Å; P361-W376 HydrophobicContact CG-CZ2 4.01Å; P361-W376 HydrophobicContact CG-CZ3 3.59Å; A372-W376 PolarHBondContact O-N 2.83Å; I373-W376 WeakPolarHBondContact O-CB 3.49Å; I373-W376 PolarHBondContact O-N 2.86Å; W376-L378 VanDerWaalsContact C-N 3.29Å; W376-L378 PolarHBondContact O-N 3.29Å; W376-G379 WeakPolarHBondContact O-CA 3.43Å; W376-G379 PolarHBondContact O-N 3.11Å; W376-C380 PolarHBondContact O-N 3.44Å; W376-Y392 HydrophobicContact CH2-CE2 4.48Å; W376-Y392 HydrophobicContact CZ2-CD2 4.27Å; W376-Y392 HydrophobicContact CZ2-CE2 4.06Å; W376-I404 HydrophobicContact CH2-CD1 4.19Å; W376-I404 HydrophobicContact CH2-CG1 4.24Å; W376-I404 HydrophobicContact CH2-CG2 3.88Å; W376-I404 HydrophobicContact CZ2-CD1 3.61Å; W376-I404 HydrophobicContact CZ2-CG1 3.88Å; W376-I404 HydrophobicContact CZ2-CG2 4.37Å; W376-L499 HydrophobicContact CD2-CD2 3.85Å; W376-L499 HydrophobicContact CE3-CB 4.4Å; W376-L499 HydrophobicContact CE3-CD2 4.09Å; W376-L499 HydrophobicContact CG-CD2 4.33Å; W376-L499 HydrophobicContact CH2-CB 4.35Å; W376-L499 HydrophobicContact CH2-CD2 4.3Å; W376-L499 HydrophobicContact CZ2-CD2 4.09Å; W376-L499 VanDerWaalsContact CZ3-C 3.5Å; W376-L499 HydrophobicContact CZ3-CB 4.09Å; W376-L499 HydrophobicContact CZ3-CD2 4.32Å; W376-L499 WeakPolarHBondContact CZ3-O 3.48Å; W376-I501 HydrophobicContact CZ3-CG1 4.34Å
377	S	98.9	Very high	98.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-56.7	-42.9	176	-58.6	0	0	0	0	112.1	L316 Q354 Y358 I373 D374 G379 C380 V381	L316-S377 WeakPolarHBondContact O-CB 3.44Å; Q354-S377 PolarHBondContact NE2-OG 3.23Å; Y358-S377 WeakPolarHBondContact O-CA 3.42Å; Y358-S377 PolarHBondContact O-OG 3.19Å; I373-S377 PolarHBondContact O-N 3.13Å; I373-S377 VanDerWaalsContact O-N 3.1Å; I373-S377 PolarHBondContact O-OG 3.03Å; D374-S377 PolarHBondContact O-N 3.37Å; S377-G379 VanDerWaalsContact C-N 3.32Å; S377-G379 PolarHBondContact O-N 2.92Å; S377-C380 PolarHBondContact O-N 3.19Å; S377-V381 WeakPolarHBondContact O-CG2 3.42Å; S377-V381 PolarHBondContact O-N 2.81Å
378	L	98.9	Very high	98.4	Very high	2 Å²	2	10.1 Å²	10.1	1%	0.01	6%	0.062	C	C	.	.	H	α-helix	trans	-61.4	-38.6	175.5	-177.9	54.3	0	0	0	112.3	L296 V299 A300 L303 L316 D374 M375 W376 V381 I382 M498	L296-L378 HydrophobicContact CD1-CD1 3.95Å; L296-L378 HydrophobicContact CD1-CD2 3.76Å; L296-L378 HydrophobicContact CD1-CG 3.85Å; V299-L378 HydrophobicContact CB-CD1 4.09Å; V299-L378 HydrophobicContact CG1-CD1 3.74Å; V299-L378 HydrophobicContact CG1-CD2 4.32Å; A300-L378 HydrophobicContact CB-CD2 4.33Å; L303-L378 HydrophobicContact CD1-CB 4.21Å; L303-L378 HydrophobicContact CD1-CD2 3.82Å; L316-L378 HydrophobicContact CD2-CB 4.01Å; D374-L378 WeakPolarHBondContact O-CB 3.33Å; D374-L378 PolarHBondContact O-N 2.89Å; M375-L378 HydrophobicContact CE-CD2 4.33Å; M375-L378 HydrophobicContact SD-CD2 4.25Å; W376-L378 VanDerWaalsContact C-N 3.29Å; W376-L378 PolarHBondContact O-N 3.29Å; L378-V381 PolarHBondContact O-N 3.18Å; L378-I382 HydrophobicContact CD1-CG2 4.24Å; L378-I382 PolarHBondContact O-N 3.03Å; L378-M498 HydrophobicContact CD2-CE 4.47Å; L378-M498 HydrophobicContact CG-SD 4.47Å
379	G	98.9	Very high	98.5	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-59	-47.1	171.2	0	0	0	0	0	112.6	M375 W376 S377 V381 I382 A383 L495	M375-G379 PolarHBondContact O-N 3.45Å; M375-G379 VanDerWaalsContact O-N 3.13Å; W376-G379 WeakPolarHBondContact O-CA 3.43Å; W376-G379 PolarHBondContact O-N 3.11Å; S377-G379 VanDerWaalsContact C-N 3.32Å; S377-G379 PolarHBondContact O-N 2.92Å; G379-V381 PolarHBondContact O-N 2.89Å; G379-I382 WeakPolarHBondContact O-CG1 3.38Å; G379-A383 WeakPolarHBondContact O-CB 3.36Å; G379-A383 PolarHBondContact O-N 3.03Å; G379-A383 VanDerWaalsContact O-N 3.11Å; G379-L495 WeakPolarHBondContact O-CD1 3.31Å
380	C	98.9	Very high	98.5	Very high	3 Å²	3	9.9 Å²	9.9	2%	0.02	5%	0.051	C	C	.	.	H	α-helix	trans	-62.6	-40.4	174.5	-69.1	0	0	0	0	112.4	Y358 W376 S377 A383 E384	Y358-C380 HydrophobicContact CD1-CB 3.79Å; W376-C380 PolarHBondContact O-N 3.44Å; S377-C380 PolarHBondContact O-N 3.19Å; C380-A383 PolarHBondContact O-N 3.36Å; C380-E384 WeakPolarHBondContact O-CB 3.44Å; C380-E384 PolarHBondContact O-N 3.02Å
381	V	98.9	Very high	98.6	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.006	4%	0.041	C	C	.	.	H	α-helix	trans	-62.6	-47.8	178.1	168.6	0	0	0	0	112	P318 I321 Y358 S377 L378 G379 A383 E384 L385	P318-V381 HydrophobicContact CG-CG1 4.49Å; P318-V381 HydrophobicContact CG-CG2 4.16Å; I321-V381 HydrophobicContact CD1-CG1 3.92Å; I321-V381 HydrophobicContact CD1-CG2 4.4Å; Y358-V381 HydrophobicContact CD1-CG2 4.17Å; Y358-V381 HydrophobicContact CE1-CG2 4.42Å; S377-V381 WeakPolarHBondContact O-CG2 3.42Å; S377-V381 PolarHBondContact O-N 2.81Å; L378-V381 PolarHBondContact O-N 3.18Å; G379-V381 PolarHBondContact O-N 2.89Å; V381-A383 VanDerWaalsContact C-N 3.34Å; V381-A383 PolarHBondContact O-N 2.86Å; V381-E384 PolarHBondContact O-N 2.92Å; V381-L385 HydrophobicContact CG1-CD1 4.27Å; V381-L385 WeakPolarHBondContact O-CG 3.36Å; V381-L385 PolarHBondContact O-N 3.44Å
382	I	98.8	Very high	98.6	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-68.9	-35.3	179.9	66.4	179.5	0	0	0	111.8	I292 L296 L378 G379 E384 L385 F386 Y491 L495 M498	I292-I382 HydrophobicContact CG2-CB 3.96Å; I292-I382 HydrophobicContact CG2-CG2 4.03Å; L296-I382 HydrophobicContact CB-CG2 4.14Å; L296-I382 HydrophobicContact CD1-CD1 4.47Å; L296-I382 HydrophobicContact CD1-CG2 4.05Å; L296-I382 HydrophobicContact CD2-CD1 4.11Å; L296-I382 HydrophobicContact CG-CG2 4.45Å; L378-I382 HydrophobicContact CD1-CG2 4.24Å; L378-I382 PolarHBondContact O-N 3.03Å; G379-I382 WeakPolarHBondContact O-CG1 3.38Å; I382-E384 VanDerWaalsContact C-N 3.33Å; I382-E384 PolarHBondContact O-N 3.05Å; I382-L385 PolarHBondContact O-N 3.34Å; I382-F386 VanDerWaalsContact O-CB 3.32Å; I382-F386 WeakPolarHBondContact O-CB 3.34Å; I382-F386 PolarHBondContact O-N 3.08Å; I382-Y491 VanDerWaalsContact C-OH 3.26Å; I382-Y491 HydrophobicContact CB-CE2 4.3Å; I382-Y491 HydrophobicContact CD1-CE2 3.91Å; I382-Y491 HydrophobicContact CG1-CE2 4.1Å; I382-Y491 PolarHBondContact O-OH 3.31Å; I382-L495 HydrophobicContact CD1-CD1 4.3Å; I382-L495 HydrophobicContact CG1-CD1 4.05Å; I382-M498 HydrophobicContact CD1-CE 4.22Å; I382-M498 HydrophobicContact CD1-SD 3.54Å; I382-M498 VanDerWaalsContact CD1-SD 3.54Å; I382-M498 HydrophobicContact CG1-SD 4.48Å
383	A	98.8	Very high	98.6	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-61.1	-41.4	171.5	0	0	0	0	0	112	G379 C380 V381 F386 L387 L391 M467 Y491 L495	G379-A383 WeakPolarHBondContact O-CB 3.36Å; G379-A383 PolarHBondContact O-N 3.03Å; G379-A383 VanDerWaalsContact O-N 3.11Å; C380-A383 PolarHBondContact O-N 3.36Å; V381-A383 VanDerWaalsContact C-N 3.34Å; V381-A383 PolarHBondContact O-N 2.86Å; A383-F386 PolarHBondContact O-N 3.02Å; A383-L387 WeakPolarHBondContact O-CB 3.27Å; A383-L387 VanDerWaalsContact O-CG 3.26Å; A383-L387 WeakPolarHBondContact O-CG 3.33Å; A383-L387 PolarHBondContact O-N 3.38Å; A383-L391 HydrophobicContact CB-CB 3.96Å; A383-L391 HydrophobicContact CB-CD2 3.85Å; A383-L391 HydrophobicContact CB-CG 4.38Å; A383-M467 HydrophobicContact CB-CE 4.03Å; A383-Y491 WeakPolarHBondContact CA-OH 3.36Å; A383-Y491 PolarHBondContact N-OH 2.96Å; A383-L495 HydrophobicContact CB-CD1 4.13Å; A383-L495 HydrophobicContact CB-CD2 4.19Å
384	E	98.7	Very high	98.6	Very high	2 Å²	2	7.1 Å²	7.1	1%	0.009	3%	0.032	C	C	.	.	H	α-helix	trans	-65.7	-44.3	176.8	178.5	162.3	163.1	0	0	112.7	L279 Y358 C380 V381 I382 F386 L387 G388 W389 P390	L279-E384 HydrophobicContact CD1-CG 3.99Å; Y358-E384 WeakPolarHBondContact CE1-OE2 3.35Å; Y358-E384 PolarHBondContact OH-OE2 3.04Å; C380-E384 WeakPolarHBondContact O-CB 3.44Å; C380-E384 PolarHBondContact O-N 3.02Å; V381-E384 PolarHBondContact O-N 2.92Å; I382-E384 VanDerWaalsContact C-N 3.33Å; I382-E384 PolarHBondContact O-N 3.05Å; E384-F386 VanDerWaalsContact C-N 3.25Å; E384-F386 PolarHBondContact O-N 3.15Å; E384-L387 PolarHBondContact O-N 3.34Å; E384-G388 WeakPolarHBondContact O-CA 3.38Å; E384-G388 PolarHBondContact O-N 3.3Å; E384-W389 WeakPolarHBondContact CA-O 3.49Å; E384-W389 PolarHBondContact O-N 3.37Å; E384-P390 WeakPolarHBondContact OE2-CA 3.2Å; E384-P390 WeakPolarHBondContact OE2-CB 3.47Å; E384-P390 WeakPolarHBondContact OE2-CG 3.48Å
385	L	98.6	Very high	98.5	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-57.4	-40.3	173.1	-67.7	168.4	0	0	0	111.5	L275 L279 L287 I292 I295 V381 I382	L275-L385 HydrophobicContact CD1-CD1 4.32Å; L275-L385 HydrophobicContact CD1-CD2 4.42Å; L279-L385 HydrophobicContact CD1-CD2 4.13Å; L279-L385 HydrophobicContact CD2-CD2 4.17Å; L279-L385 HydrophobicContact CG-CD2 4.13Å; L287-L385 VanDerWaalsContact CB-O 3.3Å; L287-L385 WeakPolarHBondContact CB-O 3.32Å; L287-L385 HydrophobicContact CD2-CD2 4.33Å; L287-L385 PolarHBondContact N-O 3.29Å; I292-L385 HydrophobicContact CD1-CB 3.75Å; I292-L385 HydrophobicContact CG1-CB 3.89Å; I292-L385 HydrophobicContact CG2-CD1 4.45Å; I295-L385 HydrophobicContact CD1-CD1 4.32Å; I295-L385 HydrophobicContact CG2-CD1 4.26Å; V381-L385 HydrophobicContact CG1-CD1 4.27Å; V381-L385 WeakPolarHBondContact O-CG 3.36Å; V381-L385 PolarHBondContact O-N 3.44Å; I382-L385 PolarHBondContact O-N 3.34Å
386	F	98.4	Very high	98.4	Very high	8 Å²	8	9.2 Å²	9.2	4%	0.035	5%	0.049	C	C	.	.	H	α-helix	trans	-74.3	-27.4	-178.9	179.2	-103.1	0	0	0	114.1	P286 L289 I292 I382 A383 E384 M467 V470 Y491	P286-F386 WeakPolarHBondContact CB-O 3.29Å; L289-F386 HydrophobicContact CD1-CE2 4.4Å; L289-F386 HydrophobicContact CD2-CD2 3.57Å; L289-F386 HydrophobicContact CD2-CE2 3.75Å; L289-F386 HydrophobicContact CG-CD2 4.18Å; L289-F386 HydrophobicContact CG-CE2 4.02Å; I292-F386 HydrophobicContact CD1-CB 3.7Å; I292-F386 HydrophobicContact CD1-CD2 4.38Å; I382-F386 VanDerWaalsContact O-CB 3.32Å; I382-F386 WeakPolarHBondContact O-CB 3.34Å; I382-F386 PolarHBondContact O-N 3.08Å; A383-F386 PolarHBondContact O-N 3.02Å; E384-F386 VanDerWaalsContact C-N 3.25Å; E384-F386 PolarHBondContact O-N 3.15Å; F386-M467 HydrophobicContact CD1-CE 3.99Å; F386-M467 HydrophobicContact CE1-CB 4.33Å; F386-M467 HydrophobicContact CE1-CE 4.33Å; F386-M467 WeakPolarHBondContact CE1-O 3.27Å; F386-V470 HydrophobicContact CE1-CG2 4.18Å; F386-Y491 HydrophobicContact CB-CE1 4.2Å; F386-Y491 VanDerWaalsContact CB-OH 3.32Å; F386-Y491 WeakPolarHBondContact CB-OH 3.33Å; F386-Y491 AromaticContact CD1-CE1 3.79Å; F386-Y491 HydrophobicContact CD1-CE1 3.79Å; F386-Y491 HydrophobicContact CD2-CD1 4.32Å; F386-Y491 AromaticContact CD2-CE1 3.76Å; F386-Y491 HydrophobicContact CD2-CE1 3.76Å; F386-Y491 AromaticContact CE1-CE1 3.98Å; F386-Y491 HydrophobicContact CE1-CE1 3.98Å; F386-Y491 HydrophobicContact CE2-CD1 4.15Å; F386-Y491 AromaticContact CE2-CE1 3.94Å; F386-Y491 HydrophobicContact CE2-CE1 3.94Å; F386-Y491 AromaticContact CG-CE1 3.66Å; F386-Y491 HydrophobicContact CG-CE1 3.66Å; F386-Y491 AromaticContact CG-CZ 3.92Å; F386-Y491 HydrophobicContact CZ-CD1 4.29Å; F386-Y491 HydrophobicContact CZ-CE1 4.03Å
387	L	97.9	Very high	98.3	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.01	6%	0.056	C	C	.	.	H	α-helix	trans	-98.5	-18.6	179.5	-65.8	174.7	0	0	0	113.5	A383 E384 W389 L391 Y459 F461 M467 V470	A383-L387 WeakPolarHBondContact O-CB 3.27Å; A383-L387 VanDerWaalsContact O-CG 3.26Å; A383-L387 WeakPolarHBondContact O-CG 3.33Å; A383-L387 PolarHBondContact O-N 3.38Å; E384-L387 PolarHBondContact O-N 3.34Å; L387-W389 PolarHBondContact O-N 2.98Å; L387-L391 HydrophobicContact CD1-CD1 3.99Å; L387-Y459 HydrophobicContact CB-CD2 4.1Å; L387-Y459 HydrophobicContact CB-CE2 3.93Å; L387-Y459 HydrophobicContact CD1-CD2 4.27Å; L387-Y459 HydrophobicContact CD2-CD2 4.02Å; L387-Y459 HydrophobicContact CD2-CE2 4.17Å; L387-Y459 HydrophobicContact CD2-CG 4.32Å; L387-Y459 HydrophobicContact CG-CD2 4.36Å; L387-Y459 WeakPolarHBondContact O-CE2 3.35Å; L387-F461 HydrophobicContact CD1-CE2 4Å; L387-F461 HydrophobicContact CD2-CE2 4.17Å; L387-F461 HydrophobicContact CD2-CZ 3.89Å; L387-M467 HydrophobicContact CD1-CE 4.05Å; L387-M467 HydrophobicContact CD2-CE 4.37Å; L387-M467 HydrophobicContact CG-CE 4.21Å; L387-V470 HydrophobicContact CD2-CG2 3.77Å
388	G	97.7	Very high	98.3	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.9	20	-163.3	0	0	0	0	0	113	F284 E384	F284-G388 WeakPolarHBondContact CB-O 3.43Å; E384-G388 WeakPolarHBondContact O-CA 3.38Å; E384-G388 PolarHBondContact O-N 3.3Å
389	W	98.1	Very high	98.3	Very high	93 Å²	93	10.6 Å²	10.6	35%	0.352	6%	0.055	S	C	.	.	S	Bend	trans	-159.4	142.4	-176.7	-164	-95.2	0	0	0	110.8	E384 L387 L391 A456 K458 Y459	E384-W389 WeakPolarHBondContact CA-O 3.49Å; E384-W389 PolarHBondContact O-N 3.37Å; L387-W389 PolarHBondContact O-N 2.98Å; W389-L391 PolarHBondContact O-N 2.94Å; W389-A456 PolarHBondContact NE1-O 3.08Å; W389-A456 VanDerWaalsContact NE1-O 3.13Å; W389-K458 HydrophobicContact CB-CB 4.18Å; W389-K458 HydrophobicContact CB-CD 3.86Å; W389-K458 VanDerWaalsContact CD1-CB 3.5Å; W389-K458 HydrophobicContact CD2-CB 3.87Å; W389-K458 HydrophobicContact CD2-CD 4.03Å; W389-K458 HydrophobicContact CE3-CD 4.19Å; W389-K458 HydrophobicContact CG-CB 3.57Å; W389-K458 HydrophobicContact CG-CD 3.9Å; W389-K458 HydrophobicContact CG-CG 4.42Å; W389-Y459 HydrophobicContact CB-CE2 4.38Å
390	P	98.4	Very high	98.2	Very high	20 Å²	20	10.6 Å²	10.6	13%	0.13	6%	0.056	C	C	.	.			trans	-56	134.4	178.5	-20.4	26.3	0	0	0	112.3	Y357 E384 P393	Y357-P390 HydrophobicContact CD2-CB 4.11Å; Y357-P390 HydrophobicContact CD2-CG 4.11Å; Y357-P390 HydrophobicContact CE2-CG 4.42Å; E384-P390 WeakPolarHBondContact OE2-CA 3.2Å; E384-P390 WeakPolarHBondContact OE2-CB 3.47Å; E384-P390 WeakPolarHBondContact OE2-CG 3.48Å; P390-P393 HydrophobicContact CB-CB 4.19Å
391	L	98.4	Very high	98.2	Very high	7 Å²	7	10.5 Å²	10.5	4%	0.037	6%	0.055	C	C	.	.	S	Bend	trans	-64.9	-43	-179.7	-179.9	64.7	0	0	0	112	A383 L387 W389 F461 L464 M467 L499	A383-L391 HydrophobicContact CB-CB 3.96Å; A383-L391 HydrophobicContact CB-CD2 3.85Å; A383-L391 HydrophobicContact CB-CG 4.38Å; L387-L391 HydrophobicContact CD1-CD1 3.99Å; W389-L391 PolarHBondContact O-N 2.94Å; L391-F461 HydrophobicContact CD1-CD2 4.12Å; L391-F461 HydrophobicContact CD1-CE2 4.2Å; L391-L464 HydrophobicContact CD2-CD2 4.13Å; L391-M467 HydrophobicContact CD1-CE 4.37Å; L391-M467 HydrophobicContact CD1-SD 3.87Å; L391-L499 HydrophobicContact CD2-CD1 3.48Å; L391-L499 VanDerWaalsContact CD2-CD1 3.48Å
392	Y	98.6	Very high	98.2	Very high	1 Å²	1	12 Å²	12	0%	0.004	6%	0.06	C	C	.	.			trans	-127.4	78.5	-178.5	-57.4	-45.4	0	0	0	110.9	Y357 W376 G394 Q400 I404 T407 Q408 L499	Y357-Y392 WeakPolarHBondContact CA-O 3.21Å; Y357-Y392 WeakPolarHBondContact CB-O 3.46Å; W376-Y392 HydrophobicContact CH2-CE2 4.48Å; W376-Y392 HydrophobicContact CZ2-CD2 4.27Å; W376-Y392 HydrophobicContact CZ2-CE2 4.06Å; Y392-G394 VanDerWaalsContact C-N 3.26Å; Y392-G394 PolarHBondContact O-N 3.11Å; Y392-Q400 VanDerWaalsContact CB-NE2 3.3Å; Y392-Q400 PolarHBondContact O-NE2 2.97Å; Y392-Q400 PolarHBondContact O-OE1 3.01Å; Y392-I404 HydrophobicContact CD1-CG1 4.44Å; Y392-I404 HydrophobicContact CD2-CD1 4.46Å; Y392-I404 HydrophobicContact CD2-CG1 3.65Å; Y392-I404 HydrophobicContact CE2-CG1 3.75Å; Y392-I404 HydrophobicContact CG-CG1 4.02Å; Y392-T407 HydrophobicContact CE1-CG2 4.34Å; Y392-Q408 WeakPolarHBondContact OH-CG 3.48Å; Y392-Q408 PolarHBondContact OH-OE1 3.17Å; Y392-L499 HydrophobicContact CE2-CD1 4.39Å
393	P	98.3	Very high	98.2	Very high	5 Å²	5	11.9 Å²	11.9	3%	0.032	6%	0.06	C	C	.	.			trans	-83.4	56.7	-178.9	33.6	-33.3	0	0	0	112.1	Y357 P390 A395 Y403 A456 R457	Y357-P393 VanDerWaalsContact CD1-CA 3.45Å; Y357-P393 HydrophobicContact CD1-CB 4.44Å; Y357-P393 VanDerWaalsContact CE1-C 3.44Å; Y357-P393 HydrophobicContact CE1-CB 4.24Å; Y357-P393 HydrophobicContact CE2-CB 4.37Å; P390-P393 HydrophobicContact CB-CB 4.19Å; P393-A395 PolarHBondContact O-N 2.84Å; P393-Y403 HydrophobicContact CG-CE2 4.1Å; P393-Y403 WeakPolarHBondContact O-CE2 3.36Å; P393-A456 HydrophobicContact CB-CB 4.23Å; P393-A456 HydrophobicContact CG-CB 4Å; P393-A456 VanDerWaalsContact CG-O 3.29Å; P393-A456 WeakPolarHBondContact CG-O 3.47Å; P393-R457 HydrophobicContact CG-CG 3.86Å
394	G	97.9	Very high	98.2	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.06	C	C	.	.			trans	-65.5	121.8	-173.5	0	0	0	0	0	112.6	R356 Y357 Y392 S396	R356-G394 WeakPolarHBondContact CD-O 3.04Å; Y357-G394 WeakPolarHBondContact CE1-O 3.43Å; Y392-G394 VanDerWaalsContact C-N 3.26Å; Y392-G394 PolarHBondContact O-N 3.11Å; G394-S396 VanDerWaalsContact C-N 3.33Å; G394-S396 PolarHBondContact O-N 2.67Å
395	A	96.8	Very high	98.2	Very high	35 Å²	35	12.4 Å²	12.4	29%	0.289	6%	0.064	S	C	.	.	S	Bend	trans	-66.5	-36.5	177.1	0	0	0	0	0	111.9	R356 P393 K454	R356-A395 PolarHBondContact NH1-O 3.07Å; P393-A395 PolarHBondContact O-N 2.84Å; A395-K454 HydrophobicContact CB-CB 3.98Å; A395-K454 HydrophobicContact CB-CD 4.01Å; A395-K454 HydrophobicContact CB-CG 4.31Å
396	S	97.3	Very high	98.1	Very high	13 Å²	13	16.6 Å²	16.6	9%	0.091	8%	0.083	C	C	.	.	S	Bend	trans	-120.6	170.7	174.1	65.8	0	0	0	0	111.7	G394 Y398 D399 Q400	G394-S396 VanDerWaalsContact C-N 3.33Å; G394-S396 PolarHBondContact O-N 2.67Å; S396-Y398 PolarHBondContact O-N 3.23Å; S396-Y398 PolarHBondContact OG-N 2.85Å; S396-D399 WeakPolarHBondContact CB-OD2 3.26Å; S396-D399 PolarHBondContact N-OD2 2.96Å; S396-D399 VanDerWaalsContact N-OD2 3.15Å; S396-D399 PolarHBondContact O-N 3.22Å; S396-D399 VanDerWaalsContact OG-CG 3.24Å; S396-D399 PolarHBondContact OG-N 3.36Å; S396-D399 PolarHBondContact OG-OD2 2.99Å; S396-Q400 WeakPolarHBondContact O-CB 3.46Å; S396-Q400 PolarHBondContact O-N 3.43Å
397	E	97.3	Very high	98.1	Very high	29 Å²	29	16.4 Å²	16.4	14%	0.136	8%	0.083	C	C	.	.	H	α-helix	trans	-61.4	-31	169.8	-68.6	-153.2	119.6	0	0	112.1	Y352 R359 I364 I401 K421 F425	Y352-E397 HydrophobicContact CE2-CG 4.48Å; R359-E397 IonicContact CZ-OE1 2.85Å; R359-E397 IonicContact NH1-OE1 3.65Å; R359-E397 PolarHBondContact NH1-OE1 3.5Å; I364-E397 HydrophobicContact CG2-CB 4.33Å; E397-I401 PolarHBondContact O-N 3.32Å; E397-I401 VanDerWaalsContact O-N 3.15Å; E397-K421 IonicContact OE1-NZ 3.64Å; E397-K421 PolarHBondContact OE1-NZ 3.36Å; E397-K421 WeakPolarHBondContact OE2-CE 3.41Å; E397-K421 IonicContact OE2-NZ 3.93Å; E397-K421 PolarHBondContact OE2-NZ 2.88Å; E397-F425 HydrophobicContact CB-CE1 3.74Å; E397-F425 HydrophobicContact CB-CZ 3.83Å
398	Y	98.3	Very high	98.1	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-66.5	-48.9	173.6	170.2	-99.9	0	0	0	111.7	S396 Q400 I401 R402 F425 L439 K440 T441 P442 H445 S453	S396-Y398 PolarHBondContact O-N 3.23Å; S396-Y398 PolarHBondContact OG-N 2.85Å; Y398-Q400 VanDerWaalsContact C-N 3.26Å; Y398-Q400 PolarHBondContact O-N 3.36Å; Y398-I401 WeakPolarHBondContact O-CG2 3.5Å; Y398-I401 PolarHBondContact O-N 3.41Å; Y398-R402 WeakPolarHBondContact O-CB 3.34Å; Y398-R402 PolarHBondContact O-N 3.12Å; Y398-F425 HydrophobicContact CD2-CB 4.24Å; Y398-F425 HydrophobicContact CD2-CD1 4.36Å; Y398-L439 HydrophobicContact CE2-CD1 4.33Å; Y398-L439 HydrophobicContact CE2-CD2 4.49Å; Y398-L439 HydrophobicContact CE2-CG 4.2Å; Y398-K440 HydrophobicContact CE2-CB 4.16Å; Y398-K440 PolarHBondContact OH-O 2.99Å; Y398-T441 PolarHBondContact OH-O 2.93Å; Y398-P442 VanDerWaalsContact OH-N 3.17Å; Y398-H445 WeakPolarHBondContact CB-NE2 3.41Å; Y398-H445 HydrophobicContact CD1-CB 4.18Å; Y398-H445 AromaticContact CD1-CG 3.79Å; Y398-H445 AromaticContact CD1-ND1 3.79Å; Y398-H445 HydrophobicContact CD2-CB 4.1Å; Y398-H445 AromaticContact CD2-CD2 3.59Å; Y398-H445 AromaticContact CD2-CG 3.79Å; Y398-H445 HydrophobicContact CE1-CB 4.1Å; Y398-H445 HydrophobicContact CE2-CB 4Å; Y398-H445 HydrophobicContact CG-CB 4.19Å; Y398-H445 AromaticContact CG-CD2 3.53Å; Y398-H445 AromaticContact CG-CE1 3.91Å; Y398-H445 AromaticContact CG-CG 3.57Å; Y398-H445 AromaticContact CG-ND1 3.81Å; Y398-H445 AromaticContact CG-NE2 3.76Å; Y398-S453 VanDerWaalsContact CE1-OG 3.29Å; Y398-S453 WeakPolarHBondContact CE1-OG 3.37Å
399	D	98.3	Very high	98.1	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-60.8	-38.1	176.3	-63.8	-59.1	0	0	0	111.5	S396 R402 Y403 S453	S396-D399 WeakPolarHBondContact CB-OD2 3.26Å; S396-D399 PolarHBondContact N-OD2 2.96Å; S396-D399 VanDerWaalsContact N-OD2 3.15Å; S396-D399 PolarHBondContact O-N 3.22Å; S396-D399 VanDerWaalsContact OG-CG 3.24Å; S396-D399 PolarHBondContact OG-N 3.36Å; S396-D399 PolarHBondContact OG-OD2 2.99Å; D399-R402 PolarHBondContact O-N 3.34Å; D399-R402 IonicContact OD1-CZ 3.31Å; D399-R402 IonicContact OD1-NE 3.14Å; D399-R402 PolarHBondContact OD1-NE 2.9Å; D399-R402 IonicContact OD1-NH2 3.61Å; D399-R402 PolarHBondContact OD1-NH2 3.23Å; D399-Y403 WeakPolarHBondContact O-CB 3.43Å; D399-Y403 WeakPolarHBondContact O-CD1 3.5Å; D399-Y403 WeakPolarHBondContact O-CD2 3.43Å; D399-Y403 PolarHBondContact O-N 2.68Å; D399-S453 WeakPolarHBondContact OD1-CB 3.42Å
400	Q	98.6	Very high	97.9	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-59.1	-52.4	176.9	-165.3	67.6	27.3	0	0	111.4	R356 Y357 I364 Y392 S396 Y398 Y403 I404	R356-Q400 PolarHBondContact O-NE2 3.44Å; R356-Q400 PolarHBondContact O-OE1 3.1Å; Y357-Q400 PolarHBondContact O-NE2 3.31Å; Y357-Q400 VanDerWaalsContact O-NE2 3.13Å; I364-Q400 HydrophobicContact CD1-CB 4.08Å; I364-Q400 HydrophobicContact CD1-CG 3.59Å; Y392-Q400 VanDerWaalsContact CB-NE2 3.3Å; Y392-Q400 PolarHBondContact O-NE2 2.97Å; Y392-Q400 PolarHBondContact O-OE1 3.01Å; S396-Q400 WeakPolarHBondContact O-CB 3.46Å; S396-Q400 PolarHBondContact O-N 3.43Å; Y398-Q400 VanDerWaalsContact C-N 3.26Å; Y398-Q400 PolarHBondContact O-N 3.36Å; Q400-Y403 PolarHBondContact O-N 3.37Å; Q400-I404 HydrophobicContact CG-CD1 4.38Å; Q400-I404 WeakPolarHBondContact O-CD1 3.39Å; Q400-I404 VanDerWaalsContact O-CG1 3.3Å; Q400-I404 WeakPolarHBondContact O-CG1 3.49Å; Q400-I404 PolarHBondContact O-N 3.1Å
401	I	98.5	Very high	97.9	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-74	-27.4	179.4	-162.3	63.3	0	0	0	112.7	P361 I364 E397 Y398 I404 S405 P411 F425 F426 L439	P361-I401 HydrophobicContact CB-CD1 4.4Å; I364-I401 HydrophobicContact CD1-CB 4.47Å; I364-I401 HydrophobicContact CD1-CD1 4.46Å; I364-I401 HydrophobicContact CG2-CB 4.06Å; I364-I401 HydrophobicContact CG2-CG2 4.44Å; E397-I401 PolarHBondContact O-N 3.32Å; E397-I401 VanDerWaalsContact O-N 3.15Å; Y398-I401 WeakPolarHBondContact O-CG2 3.5Å; Y398-I401 PolarHBondContact O-N 3.41Å; I401-I404 HydrophobicContact CD1-CB 4.46Å; I401-I404 HydrophobicContact CD1-CD1 4.37Å; I401-I404 HydrophobicContact CD1-CG2 4.49Å; I401-S405 VanDerWaalsContact O-CB 3.23Å; I401-S405 WeakPolarHBondContact O-CB 3.33Å; I401-S405 PolarHBondContact O-N 2.9Å; I401-S405 PolarHBondContact O-OG 2.56Å; I401-P411 HydrophobicContact CD1-CG 4.18Å; I401-F425 HydrophobicContact CG2-CB 3.81Å; I401-F425 HydrophobicContact CG2-CD1 4.31Å; I401-F425 HydrophobicContact CG2-CD2 4.31Å; I401-F425 HydrophobicContact CG2-CG 3.89Å; I401-F426 HydrophobicContact CG1-CE2 3.91Å; I401-F426 HydrophobicContact CG1-CZ 3.8Å; I401-F426 HydrophobicContact CG2-CE2 4.38Å; I401-L439 HydrophobicContact CG2-CD1 4.38Å
402	R	98.4	Very high	97.8	Very high	32 Å²	32	21.3 Å²	21.3	12%	0.121	13%	0.128	C	C	.	.	H	α-helix	trans	-62.2	-47.5	171.1	177.8	173.2	65	83.7	-3.8	111.5	Y398 D399 S405 Q406 L439 K454 E455	Y398-R402 WeakPolarHBondContact O-CB 3.34Å; Y398-R402 PolarHBondContact O-N 3.12Å; D399-R402 PolarHBondContact O-N 3.34Å; D399-R402 IonicContact OD1-CZ 3.31Å; D399-R402 IonicContact OD1-NE 3.14Å; D399-R402 PolarHBondContact OD1-NE 2.9Å; D399-R402 IonicContact OD1-NH2 3.61Å; D399-R402 PolarHBondContact OD1-NH2 3.23Å; R402-S405 PolarHBondContact O-N 3.43Å; R402-Q406 WeakPolarHBondContact O-CB 3.41Å; R402-Q406 PolarHBondContact O-N 3.23Å; R402-L439 HydrophobicContact CB-CD2 3.89Å; R402-L439 HydrophobicContact CG-CD2 3.86Å; R402-K454 PolarHBondContact NH2-O 3.41Å; R402-E455 IonicContact NH1-OE2 2.8Å; R402-E455 PolarHBondContact NH1-OE2 2.8Å
403	Y	98.6	Very high	97.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-45.7	178.1	-65.3	-17.6	0	0	0	112.2	P393 D399 Q400 S405 Q406 T407 K454 E455 A456 R457	P393-Y403 HydrophobicContact CG-CE2 4.1Å; P393-Y403 WeakPolarHBondContact O-CE2 3.36Å; D399-Y403 WeakPolarHBondContact O-CB 3.43Å; D399-Y403 WeakPolarHBondContact O-CD1 3.5Å; D399-Y403 WeakPolarHBondContact O-CD2 3.43Å; D399-Y403 PolarHBondContact O-N 2.68Å; Q400-Y403 PolarHBondContact O-N 3.37Å; Y403-S405 VanDerWaalsContact C-N 3.34Å; Y403-S405 PolarHBondContact O-N 3.33Å; Y403-Q406 PolarHBondContact O-N 3.26Å; Y403-T407 PolarHBondContact O-N 2.88Å; Y403-K454 PolarHBondContact OH-O 2.99Å; Y403-E455 WeakPolarHBondContact CE1-OE1 3.21Å; Y403-E455 WeakPolarHBondContact CE1-OE2 3.21Å; Y403-E455 WeakPolarHBondContact OH-CA 3.21Å; Y403-E455 PolarHBondContact OH-OE1 3.15Å; Y403-A456 PolarHBondContact OH-N 2.83Å; Y403-R457 VanDerWaalsContact CD1-NE 3.29Å; Y403-R457 HydrophobicContact CD2-CG 4.15Å; Y403-R457 HydrophobicContact CE2-CG 4.03Å; Y403-R457 HydrophobicContact CG-CG 4.45Å
404	I	98.7	Very high	97.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.4	-49.9	174.8	-66.5	163.5	0	0	0	109.8	P361 I364 W376 Y392 Q400 I401 Q406 T407 Q408 I501	P361-I404 HydrophobicContact CG-CD1 4.47Å; I364-I404 HydrophobicContact CD1-CD1 4.06Å; W376-I404 HydrophobicContact CH2-CD1 4.19Å; W376-I404 HydrophobicContact CH2-CG1 4.24Å; W376-I404 HydrophobicContact CH2-CG2 3.88Å; W376-I404 HydrophobicContact CZ2-CD1 3.61Å; W376-I404 HydrophobicContact CZ2-CG1 3.88Å; W376-I404 HydrophobicContact CZ2-CG2 4.37Å; Y392-I404 HydrophobicContact CD1-CG1 4.44Å; Y392-I404 HydrophobicContact CD2-CD1 4.46Å; Y392-I404 HydrophobicContact CD2-CG1 3.65Å; Y392-I404 HydrophobicContact CE2-CG1 3.75Å; Y392-I404 HydrophobicContact CG-CG1 4.02Å; Q400-I404 HydrophobicContact CG-CD1 4.38Å; Q400-I404 WeakPolarHBondContact O-CD1 3.39Å; Q400-I404 VanDerWaalsContact O-CG1 3.3Å; Q400-I404 WeakPolarHBondContact O-CG1 3.49Å; Q400-I404 PolarHBondContact O-N 3.1Å; I401-I404 HydrophobicContact CD1-CB 4.46Å; I401-I404 HydrophobicContact CD1-CD1 4.37Å; I401-I404 HydrophobicContact CD1-CG2 4.49Å; I404-Q406 VanDerWaalsContact C-N 3.3Å; I404-Q406 PolarHBondContact O-N 3.47Å; I404-T407 PolarHBondContact O-N 2.76Å; I404-Q408 WeakPolarHBondContact O-CB 3.48Å; I404-Q408 PolarHBondContact O-N 3.11Å; I404-I501 HydrophobicContact CG2-CD1 4.18Å; I404-I501 HydrophobicContact CG2-CG1 4.3Å
405	S	98.2	Very high	97.3	Very high	12 Å²	12	32.6 Å²	32.6	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-63.2	-33.6	-178.4	-58	0	0	0	0	113.1	I401 R402 Y403 G409	I401-S405 VanDerWaalsContact O-CB 3.23Å; I401-S405 WeakPolarHBondContact O-CB 3.33Å; I401-S405 PolarHBondContact O-N 2.9Å; I401-S405 PolarHBondContact O-OG 2.56Å; R402-S405 PolarHBondContact O-N 3.43Å; Y403-S405 VanDerWaalsContact C-N 3.34Å; Y403-S405 PolarHBondContact O-N 3.33Å; S405-G409 WeakPolarHBondContact CA-O 3.46Å; S405-G409 CarbonylContact O-C 3.58Å; S405-G409 VanDerWaalsContact O-C 3.3Å; S405-G409 WeakPolarHBondContact O-CA 3.39Å; S405-G409 PolarHBondContact O-N 2.92Å
406	Q	97.6	Very high	97.3	Very high	88 Å²	88	31.1 Å²	31.1	41%	0.411	16%	0.163	S	C	.	.	H	α-helix	trans	-72.4	-35.5	178.6	-173.7	179.7	3.5	0	0	112.9	R402 Y403 I404 R457	R402-Q406 WeakPolarHBondContact O-CB 3.41Å; R402-Q406 PolarHBondContact O-N 3.23Å; Y403-Q406 PolarHBondContact O-N 3.26Å; I404-Q406 VanDerWaalsContact C-N 3.3Å; I404-Q406 PolarHBondContact O-N 3.47Å; Q406-R457 VanDerWaalsContact OE1-CZ 3.31Å
407	T	98.1	Very high	97.2	Very high	5 Å²	5	33.5 Å²	33.5	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-96.6	-11.8	-175.8	-62.6	0	0	0	0	113.3	Y392 Y403 I404 F461 C463 L464	Y392-T407 HydrophobicContact CE1-CG2 4.34Å; Y403-T407 PolarHBondContact O-N 2.88Å; I404-T407 PolarHBondContact O-N 2.76Å; T407-F461 WeakPolarHBondContact CB-O 3.44Å; T407-F461 HydrophobicContact CG2-CB 3.85Å; T407-F461 PolarHBondContact OG1-O 2.65Å; T407-C463 WeakPolarHBondContact O-CA 3.42Å; T407-L464 HydrophobicContact CG2-CD2 3.95Å; T407-L464 HydrophobicContact CG2-CG 4.29Å
408	Q	98.1	Very high	97.1	Very high	54 Å²	54	35.2 Å²	35.2	25%	0.252	20%	0.199	S	C	.	.	H	α-helix	trans	-132.1	-2.4	-176.3	-56.8	-167	-117	0	0	114.9	Y392 I404 L464 L499 I501	Y392-Q408 WeakPolarHBondContact OH-CG 3.48Å; Y392-Q408 PolarHBondContact OH-OE1 3.17Å; I404-Q408 WeakPolarHBondContact O-CB 3.48Å; I404-Q408 PolarHBondContact O-N 3.11Å; Q408-L464 HydrophobicContact CG-CD1 4.1Å; Q408-L464 HydrophobicContact CG-CG 4.21Å; Q408-L499 PolarHBondContact NE2-O 3.34Å; Q408-I501 HydrophobicContact CB-CD1 4.05Å
409	G	96.8	Very high	97	Very high	38 Å²	38	35.7 Å²	35.7	39%	0.392	20%	0.204	S	C	.	.			trans	81.1	165	-168	0	0	0	0	0	112.5	S405	S405-G409 WeakPolarHBondContact CA-O 3.46Å; S405-G409 CarbonylContact O-C 3.58Å; S405-G409 VanDerWaalsContact O-C 3.3Å; S405-G409 WeakPolarHBondContact O-CA 3.39Å; S405-G409 PolarHBondContact O-N 2.92Å
410	L	95.8	Very high	97	Very high	89 Å²	89	39.8 Å²	39.8	47%	0.466	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-60.7	144.7	178.6	-61	167.5	0	0	0	110.7	F426 L439	L410-F426 HydrophobicContact CD2-CD1 4.47Å; L410-F426 HydrophobicContact CD2-CE1 3.87Å; L410-L439 HydrophobicContact CD2-CB 4.16Å
411	P	97.1	Very high	96.9	Very high	4 Å²	4	40.2 Å²	40.2	3%	0.026	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-55.5	145	167.2	-21.8	32.5	0	0	0	111	L365 I401 L416 F426 I501	L365-P411 HydrophobicContact CD1-CB 4.21Å; L365-P411 HydrophobicContact CD1-CG 4.36Å; I401-P411 HydrophobicContact CD1-CG 4.18Å; P411-L416 HydrophobicContact CB-CD2 3.77Å; P411-L416 HydrophobicContact CB-CG 4.03Å; P411-L416 HydrophobicContact CG-CD2 3.99Å; P411-L416 WeakPolarHBondContact O-CD1 3.22Å; P411-L416 WeakPolarHBondContact O-CG 3.48Å; P411-F426 HydrophobicContact CG-CZ 4.19Å; P411-I501 HydrophobicContact CB-CG2 3.83Å; P411-I501 HydrophobicContact CG-CG2 4.15Å
412	A	95.6	Very high	96.8	Very high	40 Å²	40	40.3 Å²	40.3	33%	0.331	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-62.3	148.5	-175.3	0	0	0	0	0	112.7	Y414 L415 L416	A412-Y414 VanDerWaalsContact C-N 3.25Å; A412-Y414 HydrophobicContact CB-CD1 3.79Å; A412-Y414 HydrophobicContact CB-CE1 3.3Å; A412-Y414 PolarHBondContact O-N 3.04Å; A412-Y414 VanDerWaalsContact O-N 3.08Å; A412-L415 HydrophobicContact CB-CD1 4.42Å; A412-L415 WeakPolarHBondContact O-CA 3.49Å; A412-L415 WeakPolarHBondContact O-CB 3.28Å; A412-L415 PolarHBondContact O-N 3.22Å; A412-L416 PolarHBondContact O-N 3.39Å; A412-L416 VanDerWaalsContact O-N 3.1Å
413	E	93.6	Very high	96.7	Very high	101 Å²	101	43.1 Å²	43.1	47%	0.472	25%	0.253	S	S	.	.	H	α-helix	trans	-54	-35.2	-171.3	-177.6	176.2	164.7	0	0	114.2	S417 P435	E413-S417 WeakPolarHBondContact O-CB 3.45Å; E413-S417 PolarHBondContact O-N 3.36Å; E413-S417 PolarHBondContact O-OG 2.94Å; E413-P435 WeakPolarHBondContact OE1-CG 3.22Å
414	Y	95.1	Very high	96.6	Very high	121 Å²	121	50.1 Å²	50.1	48%	0.475	28%	0.279	S	S	.	.	H	α-helix	trans	-69.4	-34.3	176.2	63.9	-86.2	0	0	0	113	A412 A418 D502 K505	A412-Y414 VanDerWaalsContact C-N 3.25Å; A412-Y414 HydrophobicContact CB-CD1 3.79Å; A412-Y414 HydrophobicContact CB-CE1 3.3Å; A412-Y414 PolarHBondContact O-N 3.04Å; A412-Y414 VanDerWaalsContact O-N 3.08Å; Y414-A418 VanDerWaalsContact O-CB 3.29Å; Y414-A418 WeakPolarHBondContact O-CB 3.41Å; Y414-A418 PolarHBondContact O-N 3.3Å; Y414-A418 VanDerWaalsContact O-N 3.1Å; Y414-D502 PolarHBondContact OH-OD2 3.08Å; Y414-K505 PolarHBondContact OH-NZ 2.99Å
415	L	96.9	Very high	96.5	Very high	21 Å²	21	50.4 Å²	50.4	11%	0.11	28%	0.28	C	S	.	.	H	α-helix	trans	-69.6	-44.9	174.2	-59.8	175.8	0	0	0	110.6	L367 A412 A418 G419 I501 D502	L367-L415 HydrophobicContact CD1-CB 4.14Å; L367-L415 HydrophobicContact CD1-CD2 4.13Å; A412-L415 HydrophobicContact CB-CD1 4.42Å; A412-L415 WeakPolarHBondContact O-CA 3.49Å; A412-L415 WeakPolarHBondContact O-CB 3.28Å; A412-L415 PolarHBondContact O-N 3.22Å; L415-A418 PolarHBondContact O-N 3.17Å; L415-G419 PolarHBondContact O-N 3.25Å; L415-I501 HydrophobicContact CD1-CG2 4.08Å; L415-D502 HydrophobicContact CD1-CB 4.12Å
416	L	96.4	Very high	96.4	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-45	176.9	-65.4	-179.9	0	0	0	110.9	L365 P411 A412 A418 G419 T422 F426 W437	L365-L416 HydrophobicContact CD1-CD2 4.16Å; L365-L416 HydrophobicContact CD2-CD2 3.91Å; P411-L416 HydrophobicContact CB-CD2 3.77Å; P411-L416 HydrophobicContact CB-CG 4.03Å; P411-L416 HydrophobicContact CG-CD2 3.99Å; P411-L416 WeakPolarHBondContact O-CD1 3.22Å; P411-L416 WeakPolarHBondContact O-CG 3.48Å; A412-L416 PolarHBondContact O-N 3.39Å; A412-L416 VanDerWaalsContact O-N 3.1Å; L416-A418 VanDerWaalsContact C-N 3.31Å; L416-A418 PolarHBondContact O-N 3.5Å; L416-G419 PolarHBondContact O-N 2.73Å; L416-T422 HydrophobicContact CB-CG2 3.93Å; L416-T422 HydrophobicContact CD2-CG2 3.98Å; L416-T422 VanDerWaalsContact O-CB 3.25Å; L416-T422 WeakPolarHBondContact O-CB 3.35Å; L416-T422 VanDerWaalsContact O-CG2 3.32Å; L416-T422 WeakPolarHBondContact O-CG2 3.2Å; L416-T422 PolarHBondContact O-OG1 2.84Å; L416-F426 HydrophobicContact CD1-CD1 4.15Å; L416-F426 HydrophobicContact CD1-CE1 4.26Å; L416-F426 HydrophobicContact CD2-CD1 4.17Å; L416-F426 HydrophobicContact CD2-CD2 3.85Å; L416-F426 HydrophobicContact CD2-CE1 4Å; L416-F426 HydrophobicContact CD2-CE2 3.68Å; L416-F426 HydrophobicContact CD2-CG 4.11Å; L416-F426 HydrophobicContact CD2-CZ 3.76Å; L416-W437 HydrophobicContact CB-CB 4.45Å; L416-W437 HydrophobicContact CB-CD2 4.15Å; L416-W437 HydrophobicContact CB-CG 3.89Å; L416-W437 HydrophobicContact CD1-CB 3.51Å; L416-W437 HydrophobicContact CD1-CG 3.89Å
417	S	94.7	Very high	96.2	Very high	63 Å²	63	47.7 Å²	47.7	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-69.7	-23.6	-179.3	-56.1	0	0	0	0	114.2	E413 W437	E413-S417 WeakPolarHBondContact O-CB 3.45Å; E413-S417 PolarHBondContact O-N 3.36Å; E413-S417 PolarHBondContact O-OG 2.94Å; S417-W437 PolarHBondContact OG-NE1 3.18Å
418	A	95.9	Very high	95.7	Very high	65 Å²	65	54.7 Å²	54.7	54%	0.537	29%	0.293	S	S	.	.	H	α-helix	trans	-91.7	-15.5	174.8	0	0	0	0	0	113.9	L367 Y414 L415 L416 T420	L367-A418 VanDerWaalsContact CD2-C 3.48Å; L367-A418 HydrophobicContact CD2-CB 3.61Å; Y414-A418 VanDerWaalsContact O-CB 3.29Å; Y414-A418 WeakPolarHBondContact O-CB 3.41Å; Y414-A418 PolarHBondContact O-N 3.3Å; Y414-A418 VanDerWaalsContact O-N 3.1Å; L415-A418 PolarHBondContact O-N 3.17Å; L416-A418 VanDerWaalsContact C-N 3.31Å; L416-A418 PolarHBondContact O-N 3.5Å; A418-T420 PolarHBondContact O-N 3.08Å
419	G	96.7	Very high	94.7	Very high	11 Å²	11	53.9 Å²	53.9	11%	0.113	29%	0.291	C	S	.	.			trans	-75.5	118.3	-175.4	0	0	0	0	0	113.7	L365 L415 L416 K421 T422	L365-G419 CarbonylContact O-C 3.5Å; L365-G419 WeakPolarHBondContact O-CA 3.38Å; L415-G419 PolarHBondContact O-N 3.25Å; L416-G419 PolarHBondContact O-N 2.73Å; G419-K421 PolarHBondContact O-N 2.83Å; G419-K421 VanDerWaalsContact O-N 3.16Å; G419-T422 WeakPolarHBondContact CA-OG1 3.28Å; G419-T422 WeakPolarHBondContact O-CB 3.38Å; G419-T422 PolarHBondContact O-N 2.63Å; G419-T422 VanDerWaalsContact O-N 3.16Å; G419-T422 PolarHBondContact O-OG1 2.9Å; G419-T422 VanDerWaalsContact O-OG1 3.08Å
420	T	97.1	Very high	93.3	Very high	86 Å²	86	57.2 Å²	57.2	53%	0.528	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-21	-179.2	65.6	0	0	0	0	114.1	S350 L365 G366 A418	S350-T420 PolarHBondContact OG-OG1 3.41Å; L365-T420 PolarHBondContact O-N 3.23Å; L365-T420 VanDerWaalsContact O-N 3.08Å; G366-T420 WeakPolarHBondContact CA-OG1 3.45Å; G366-T420 PolarHBondContact O-OG1 3.24Å; G366-T420 VanDerWaalsContact O-OG1 3.08Å; A418-T420 PolarHBondContact O-N 3.08Å
421	K	96.9	Very high	92	Very high	11 Å²	11	59.7 Å²	59.7	5%	0.048	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-4.8	179.4	-62.9	166.4	63.2	-163.4	0	113	I363 I364 L365 E397 G419 T423 R424 F425	I363-K421 PolarHBondContact O-NZ 2.72Å; I364-K421 WeakPolarHBondContact O-CB 3.37Å; I364-K421 VanDerWaalsContact O-CD 3.27Å; I364-K421 WeakPolarHBondContact O-CD 3.43Å; I364-K421 WeakPolarHBondContact O-CE 3.37Å; I364-K421 PolarHBondContact O-NZ 2.87Å; L365-K421 WeakPolarHBondContact O-CB 3.44Å; L365-K421 PolarHBondContact O-N 2.73Å; E397-K421 IonicContact OE1-NZ 3.64Å; E397-K421 PolarHBondContact OE1-NZ 3.36Å; E397-K421 WeakPolarHBondContact OE2-CE 3.41Å; E397-K421 IonicContact OE2-NZ 3.93Å; E397-K421 PolarHBondContact OE2-NZ 2.88Å; G419-K421 PolarHBondContact O-N 2.83Å; G419-K421 VanDerWaalsContact O-N 3.16Å; K421-T423 VanDerWaalsContact C-N 3.32Å; K421-T423 PolarHBondContact O-N 3.47Å; K421-R424 VanDerWaalsContact O-CB 3.29Å; K421-R424 WeakPolarHBondContact O-CB 3.3Å; K421-R424 WeakPolarHBondContact O-CG 3.41Å; K421-R424 PolarHBondContact O-N 2.85Å; K421-F425 HydrophobicContact CB-CE2 4.08Å
422	T	96.9	Very high	90.5	Very high	1 Å²	1	65 Å²	65	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-51.3	-45.8	-171.4	-63.3	0	0	0	0	113.4	L416 G419 R424 F425 F426 W437	L416-T422 HydrophobicContact CB-CG2 3.93Å; L416-T422 HydrophobicContact CD2-CG2 3.98Å; L416-T422 VanDerWaalsContact O-CB 3.25Å; L416-T422 WeakPolarHBondContact O-CB 3.35Å; L416-T422 VanDerWaalsContact O-CG2 3.32Å; L416-T422 WeakPolarHBondContact O-CG2 3.2Å; L416-T422 PolarHBondContact O-OG1 2.84Å; G419-T422 WeakPolarHBondContact CA-OG1 3.28Å; G419-T422 WeakPolarHBondContact O-CB 3.38Å; G419-T422 PolarHBondContact O-N 2.63Å; G419-T422 VanDerWaalsContact O-N 3.16Å; G419-T422 PolarHBondContact O-OG1 2.9Å; G419-T422 VanDerWaalsContact O-OG1 3.08Å; T422-R424 PolarHBondContact O-N 3.11Å; T422-F425 PolarHBondContact O-N 3.41Å; T422-F426 HydrophobicContact CG2-CB 3.94Å; T422-F426 HydrophobicContact CG2-CD2 3.86Å; T422-F426 HydrophobicContact CG2-CG 4.17Å; T422-F426 PolarHBondContact O-N 3.16Å; T422-W437 HydrophobicContact CG2-CD2 4.19Å; T422-W437 HydrophobicContact CG2-CE3 3.82Å; T422-W437 HydrophobicContact CG2-CH2 3.75Å; T422-W437 HydrophobicContact CG2-CZ2 4.13Å; T422-W437 HydrophobicContact CG2-CZ3 3.6Å
423	T	95.6	Very high	88.7	Confident	92 Å²	92	65.7 Å²	65.7	56%	0.564	36%	0.358	S	S	*	.	H	α-helix	trans	-63.1	-11.2	-177.7	51.6	0	0	0	0	114.7	K421 W437 K440	K421-T423 VanDerWaalsContact C-N 3.32Å; K421-T423 PolarHBondContact O-N 3.47Å; T423-W437 HydrophobicContact CG2-CH2 3.87Å; T423-W437 HydrophobicContact CG2-CZ3 4.08Å; T423-K440 PolarHBondContact O-NZ 3.4Å
424	R	96	Very high	86.8	Confident	146 Å²	146	71 Å²	71	55%	0.551	38%	0.375	S	S	*	.	H	α-helix	trans	-69.8	-37.8	170.2	-60.8	-178.7	-178.3	-166.7	-0.2	111.5	K421 T422 K440	K421-R424 VanDerWaalsContact O-CB 3.29Å; K421-R424 WeakPolarHBondContact O-CB 3.3Å; K421-R424 WeakPolarHBondContact O-CG 3.41Å; K421-R424 PolarHBondContact O-N 2.85Å; T422-R424 PolarHBondContact O-N 3.11Å; R424-K440 PolarHBondContact O-NZ 3.13Å
425	F	97.2	Very high	85.1	Confident	6 Å²	6	66.1 Å²	66.1	3%	0.026	36%	0.358	C	S	.	.	H	α-helix	trans	-111.7	-25.5	-169.4	-37.1	-67.5	0	0	0	113.6	I364 E397 Y398 I401 K421 T422 L439 K440	I364-F425 HydrophobicContact CG2-CD2 4.34Å; I364-F425 HydrophobicContact CG2-CE2 3.74Å; I364-F425 HydrophobicContact CG2-CZ 3.93Å; I364-F425 WeakPolarHBondContact O-CE2 3.16Å; E397-F425 HydrophobicContact CB-CE1 3.74Å; E397-F425 HydrophobicContact CB-CZ 3.83Å; Y398-F425 HydrophobicContact CD2-CB 4.24Å; Y398-F425 HydrophobicContact CD2-CD1 4.36Å; I401-F425 HydrophobicContact CG2-CB 3.81Å; I401-F425 HydrophobicContact CG2-CD1 4.31Å; I401-F425 HydrophobicContact CG2-CD2 4.31Å; I401-F425 HydrophobicContact CG2-CG 3.89Å; K421-F425 HydrophobicContact CB-CE2 4.08Å; T422-F425 PolarHBondContact O-N 3.41Å; F425-L439 WeakPolarHBondContact O-CD1 3.39Å; F425-K440 WeakPolarHBondContact O-CB 3.21Å; F425-K440 WeakPolarHBondContact O-CG 3.44Å; F425-K440 PolarHBondContact O-N 3.5Å
426	F	96.3	Very high	84.3	Confident	1 Å²	1	69.9 Å²	69.9	0%	0.004	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	140.8	-176.9	-58.7	-97.8	0	0	0	110.9	L365 I401 L410 P411 L416 T422 W437 R438 L439	L365-F426 HydrophobicContact CD2-CD2 4.31Å; L365-F426 HydrophobicContact CD2-CE2 3.76Å; I401-F426 HydrophobicContact CG1-CE2 3.91Å; I401-F426 HydrophobicContact CG1-CZ 3.8Å; I401-F426 HydrophobicContact CG2-CE2 4.38Å; L410-F426 HydrophobicContact CD2-CD1 4.47Å; L410-F426 HydrophobicContact CD2-CE1 3.87Å; P411-F426 HydrophobicContact CG-CZ 4.19Å; L416-F426 HydrophobicContact CD1-CD1 4.15Å; L416-F426 HydrophobicContact CD1-CE1 4.26Å; L416-F426 HydrophobicContact CD2-CD1 4.17Å; L416-F426 HydrophobicContact CD2-CD2 3.85Å; L416-F426 HydrophobicContact CD2-CE1 4Å; L416-F426 HydrophobicContact CD2-CE2 3.68Å; L416-F426 HydrophobicContact CD2-CG 4.11Å; L416-F426 HydrophobicContact CD2-CZ 3.76Å; T422-F426 HydrophobicContact CG2-CB 3.94Å; T422-F426 HydrophobicContact CG2-CD2 3.86Å; T422-F426 HydrophobicContact CG2-CG 4.17Å; T422-F426 PolarHBondContact O-N 3.16Å; F426-W437 HydrophobicContact CB-CE3 3.72Å; F426-W437 HydrophobicContact CB-CZ3 4.26Å; F426-R438 CarbonylContact C-O 3.58Å; F426-R438 WeakPolarHBondContact CA-O 3.47Å; F426-R438 WeakPolarHBondContact CB-O 3.48Å; F426-L439 HydrophobicContact CD1-CB 4.21Å; F426-L439 HydrophobicContact CD1-CD1 3.91Å; F426-L439 HydrophobicContact CD2-CD1 4.48Å; F426-L439 HydrophobicContact CE1-CB 4.22Å; F426-L439 HydrophobicContact CE1-CD1 3.54Å; F426-L439 HydrophobicContact CE1-CG 4.5Å; F426-L439 HydrophobicContact CE2-CD1 4.14Å; F426-L439 HydrophobicContact CG-CD1 4.36Å; F426-L439 HydrophobicContact CZ-CD1 3.66Å
427	N	92.9	Very high	84.1	Confident	43 Å²	43	71.1 Å²	71.1	23%	0.23	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	140.9	168.7	-80.3	-18.7	0	0	0	109.5	W437 R438 K440	N427-W437 WeakPolarHBondContact O-CA 3.47Å; N427-R438 HydrophobicContact CB-CG 4.15Å; N427-R438 PolarHBondContact N-O 2.82Å; N427-R438 PolarHBondContact ND2-NH2 2.99Å; N427-R438 PolarHBondContact O-N 3.45Å; N427-K440 HydrophobicContact CB-CG 4.5Å; N427-K440 WeakPolarHBondContact OD1-CE 3.5Å
428	R	88.1	Confident	84	Confident	151 Å²	151	72.4 Å²	72.4	57%	0.57	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	114.8	173.1	173.3	176.4	173	151.4	3.8	107.9	P430 P435 W437	R428-P430 WeakPolarHBondContact O-CD 3.01Å; R428-P435 HydrophobicContact CG-CB 3.84Å; R428-P435 VanDerWaalsContact CZ-CB 3.44Å; R428-W437 HydrophobicContact CB-CD2 4.26Å; R428-W437 HydrophobicContact CB-CE3 3.92Å; R428-W437 HydrophobicContact CB-CH2 4.37Å; R428-W437 HydrophobicContact CB-CZ3 3.98Å
429	D	76.2	Confident	84	Confident	37 Å²	37	71 Å²	71	20%	0.198	36%	0.361	C	S	.	.			trans	-75.4	122.1	178.6	-158	-48.8	0	0	0	110.4	N431 L432 L436	D429-N431 WeakPolarHBondContact OD1-CB 3.13Å; D429-N431 PolarHBondContact OD1-N 3.3Å; D429-N431 PolarHBondContact OD1-ND2 3.24Å; D429-L432 HydrophobicContact CB-CD1 4.14Å; D429-L436 PolarHBondContact N-O 3.49Å
430	P	67.4	Low	84	Confident	109 Å²	109	70.8 Å²	70.8	71%	0.708	36%	0.356	S	S	*	.	S	Bend	trans	-85.4	-15.3	177.3	34.8	-34.6	0	0	0	113.2	R428	R428-P430 WeakPolarHBondContact O-CD 3.01Å
431	N	68.7	Low	84	Confident	141 Å²	141	69.3 Å²	69.3	75%	0.754	35%	0.347	S	S	*	.	S	Bend	trans	-93.4	-19.9	-166.1	-52.3	-65.7	0	0	0	113.7	D429	D429-N431 WeakPolarHBondContact OD1-CB 3.13Å; D429-N431 PolarHBondContact OD1-N 3.3Å; D429-N431 PolarHBondContact OD1-ND2 3.24Å
432	L	65.6	Low	84	Confident	115 Å²	115	70.8 Å²	70.8	60%	0.602	36%	0.358	S	S	*	.	S	Bend	trans	-84.3	-9.8	-173.5	-71.5	171.7	0	0	0	114.9	D429 L436	D429-L432 HydrophobicContact CB-CD1 4.14Å; L432-L436 HydrophobicContact CB-CD1 3.88Å; L432-L436 HydrophobicContact CD1-CD1 3.91Å
433	G	58.2	Low	84	Confident	54 Å²	54	76.7 Å²	76.7	56%	0.557	39%	0.386	S	S	*	.	S	Bend	trans	81.2	113.6	-177.1	0	0	0	0	0	112.4
434	Y	54.4	Low	84	Confident	214 Å²	214	75 Å²	75	84%	0.839	37%	0.371	S	S	*	.	S	Bend	trans	61.6	151.7	-162.8	-82.9	-98.6	0	0	0	114	L436	Y434-L436 PolarHBondContact O-N 3.49Å
435	P	58.5	Low	84	Confident	17 Å²	17	68.4 Å²	68.4	11%	0.11	35%	0.347	C	S	.	.			trans	-90.6	72.6	-151.1	36	-35.2	0	0	0	113.1	E413 R428 W437	E413-P435 WeakPolarHBondContact OE1-CG 3.22Å; R428-P435 HydrophobicContact CG-CB 3.84Å; R428-P435 VanDerWaalsContact CZ-CB 3.44Å; P435-W437 PolarHBondContact O-N 2.91Å
436	L	81.6	Confident	84	Confident	100 Å²	100	71.4 Å²	71.4	52%	0.524	36%	0.361	S	S	.	.			trans	-56.2	102.6	171.2	-77.6	156.1	0	0	0	110.5	D429 L432 Y434 R438	D429-L436 PolarHBondContact N-O 3.49Å; L432-L436 HydrophobicContact CB-CD1 3.88Å; L432-L436 HydrophobicContact CD1-CD1 3.91Å; Y434-L436 PolarHBondContact O-N 3.49Å; L436-R438 PolarHBondContact O-N 3.38Å
437	W	91.1	Very high	84	Confident	31 Å²	31	78.7 Å²	78.7	12%	0.117	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	119	166.6	-71.2	102.1	0	0	0	109.1	L416 S417 T422 T423 F426 N427 R428 P435	L416-W437 HydrophobicContact CB-CB 4.45Å; L416-W437 HydrophobicContact CB-CD2 4.15Å; L416-W437 HydrophobicContact CB-CG 3.89Å; L416-W437 HydrophobicContact CD1-CB 3.51Å; L416-W437 HydrophobicContact CD1-CG 3.89Å; S417-W437 PolarHBondContact OG-NE1 3.18Å; T422-W437 HydrophobicContact CG2-CD2 4.19Å; T422-W437 HydrophobicContact CG2-CE3 3.82Å; T422-W437 HydrophobicContact CG2-CH2 3.75Å; T422-W437 HydrophobicContact CG2-CZ2 4.13Å; T422-W437 HydrophobicContact CG2-CZ3 3.6Å; T423-W437 HydrophobicContact CG2-CH2 3.87Å; T423-W437 HydrophobicContact CG2-CZ3 4.08Å; F426-W437 HydrophobicContact CB-CE3 3.72Å; F426-W437 HydrophobicContact CB-CZ3 4.26Å; N427-W437 WeakPolarHBondContact O-CA 3.47Å; R428-W437 HydrophobicContact CB-CD2 4.26Å; R428-W437 HydrophobicContact CB-CE3 3.92Å; R428-W437 HydrophobicContact CB-CH2 4.37Å; R428-W437 HydrophobicContact CB-CZ3 3.98Å; P435-W437 PolarHBondContact O-N 2.91Å
438	R	93.3	Very high	84.1	Confident	90 Å²	90	81.7 Å²	81.7	34%	0.34	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.5	167.3	63.7	176.5	-172.8	81.4	-8.3	109.8	F426 N427 L436 E444	F426-R438 CarbonylContact C-O 3.58Å; F426-R438 WeakPolarHBondContact CA-O 3.47Å; F426-R438 WeakPolarHBondContact CB-O 3.48Å; N427-R438 HydrophobicContact CB-CG 4.15Å; N427-R438 PolarHBondContact N-O 2.82Å; N427-R438 PolarHBondContact ND2-NH2 2.99Å; N427-R438 PolarHBondContact O-N 3.45Å; L436-R438 PolarHBondContact O-N 3.38Å; R438-E444 IonicContact CZ-OE1 2.7Å; R438-E444 IonicContact CZ-OE2 2.69Å; R438-E444 IonicContact NH1-OE1 2.67Å; R438-E444 PolarHBondContact NH1-OE1 3.32Å; R438-E444 IonicContact NH1-OE2 3.3Å; R438-E444 PolarHBondContact NH1-OE2 3.21Å; R438-E444 IonicContact NH2-OE1 3.41Å; R438-E444 PolarHBondContact NH2-OE1 3.48Å; R438-E444 IonicContact NH2-OE2 2.69Å
439	L	95.9	Very high	84.5	Confident	36 Å²	36	77.5 Å²	77.5	19%	0.188	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	146.2	164.7	-165.2	74.3	0	0	0	108.7	Y398 I401 R402 L410 F425 F426	Y398-L439 HydrophobicContact CE2-CD1 4.33Å; Y398-L439 HydrophobicContact CE2-CD2 4.49Å; Y398-L439 HydrophobicContact CE2-CG 4.2Å; I401-L439 HydrophobicContact CG2-CD1 4.38Å; R402-L439 HydrophobicContact CB-CD2 3.89Å; R402-L439 HydrophobicContact CG-CD2 3.86Å; L410-L439 HydrophobicContact CD2-CB 4.16Å; F425-L439 WeakPolarHBondContact O-CD1 3.39Å; F426-L439 HydrophobicContact CD1-CB 4.21Å; F426-L439 HydrophobicContact CD1-CD1 3.91Å; F426-L439 HydrophobicContact CD2-CD1 4.48Å; F426-L439 HydrophobicContact CE1-CB 4.22Å; F426-L439 HydrophobicContact CE1-CD1 3.54Å; F426-L439 HydrophobicContact CE1-CG 4.5Å; F426-L439 HydrophobicContact CE2-CD1 4.14Å; F426-L439 HydrophobicContact CG-CD1 4.36Å; F426-L439 HydrophobicContact CZ-CD1 3.66Å
440	K	96.1	Very high	85.4	Confident	5 Å²	5	78.7 Å²	78.7	2%	0.022	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-63.9	149.3	165.3	-70.5	176.6	-175.8	175.1	0	109.8	Y398 T423 R424 F425 N427 E444 H445 E448	Y398-K440 HydrophobicContact CE2-CB 4.16Å; Y398-K440 PolarHBondContact OH-O 2.99Å; T423-K440 PolarHBondContact O-NZ 3.4Å; R424-K440 PolarHBondContact O-NZ 3.13Å; F425-K440 WeakPolarHBondContact O-CB 3.21Å; F425-K440 WeakPolarHBondContact O-CG 3.44Å; F425-K440 PolarHBondContact O-N 3.5Å; N427-K440 HydrophobicContact CB-CG 4.5Å; N427-K440 WeakPolarHBondContact OD1-CE 3.5Å; K440-E444 VanDerWaalsContact CA-OE2 3.28Å; K440-E444 WeakPolarHBondContact CA-OE2 3.47Å; K440-E444 HydrophobicContact CB-CB 4.2Å; K440-H445 HydrophobicContact CB-CB 4.47Å; K440-E448 WeakPolarHBondContact CD-OE1 3.29Å; K440-E448 WeakPolarHBondContact CE-OE1 3.44Å; K440-E448 IonicContact NZ-OE1 3.49Å; K440-E448 PolarHBondContact NZ-OE1 3.25Å; K440-E448 IonicContact NZ-OE2 3.67Å; K440-E448 PolarHBondContact NZ-OE2 3.47Å
441	T	96.4	Very high	86.7	Confident	55 Å²	55	77.6 Å²	77.6	34%	0.337	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-72.4	159.5	167.4	86	0	0	0	0	110.3	Y398 E443 E444 H445	Y398-T441 PolarHBondContact OH-O 2.93Å; T441-E443 WeakPolarHBondContact CB-OE2 3.45Å; T441-E443 PolarHBondContact O-N 3.01Å; T441-E443 PolarHBondContact OG1-N 3.34Å; T441-E443 PolarHBondContact OG1-OE2 2.63Å; T441-E444 HydrophobicContact CG2-CG 4.35Å; T441-E444 PolarHBondContact N-OE2 2.7Å; T441-E444 PolarHBondContact O-N 3.03Å; T441-E444 PolarHBondContact OG1-N 2.99Å; T441-H445 PolarHBondContact O-N 3.41Å
442	P	97.1	Very high	88	Confident	42 Å²	42	76.9 Å²	76.9	27%	0.273	40%	0.402	S	S	.	.	H	α-helix	trans	-52.5	-36.2	174.2	-30.5	38.7	0	0	0	113.3	Y398 E446 S453	Y398-P442 VanDerWaalsContact OH-N 3.17Å; P442-E446 VanDerWaalsContact O-CB 3.28Å; P442-E446 WeakPolarHBondContact O-CB 3.24Å; P442-E446 PolarHBondContact O-N 3.06Å; P442-S453 WeakPolarHBondContact CB-OG 3.33Å
443	E	96.9	Very high	89.4	Confident	126 Å²	126	72.9 Å²	72.9	59%	0.589	38%	0.383	S	S	*	.	H	α-helix	trans	-75.4	-40.6	-178.3	-52.2	71.3	-152.5	0	0	111.7	T441 E446 L447	T441-E443 WeakPolarHBondContact CB-OE2 3.45Å; T441-E443 PolarHBondContact O-N 3.01Å; T441-E443 PolarHBondContact OG1-N 3.34Å; T441-E443 PolarHBondContact OG1-OE2 2.63Å; E443-E446 PolarHBondContact O-N 3.31Å; E443-L447 VanDerWaalsContact O-CB 3.28Å; E443-L447 WeakPolarHBondContact O-CB 3.44Å; E443-L447 PolarHBondContact O-N 3.02Å
444	E	95.9	Very high	91.1	Very high	56 Å²	56	76.4 Å²	76.4	26%	0.262	38%	0.383	S	S	.	.	H	α-helix	trans	-61.7	-47.2	172.7	-69.6	178.4	142.2	0	0	111.2	R438 K440 T441 L447 E448	R438-E444 IonicContact CZ-OE1 2.7Å; R438-E444 IonicContact CZ-OE2 2.69Å; R438-E444 IonicContact NH1-OE1 2.67Å; R438-E444 PolarHBondContact NH1-OE1 3.32Å; R438-E444 IonicContact NH1-OE2 3.3Å; R438-E444 PolarHBondContact NH1-OE2 3.21Å; R438-E444 IonicContact NH2-OE1 3.41Å; R438-E444 PolarHBondContact NH2-OE1 3.48Å; R438-E444 IonicContact NH2-OE2 2.69Å; K440-E444 VanDerWaalsContact CA-OE2 3.28Å; K440-E444 WeakPolarHBondContact CA-OE2 3.47Å; K440-E444 HydrophobicContact CB-CB 4.2Å; T441-E444 HydrophobicContact CG2-CG 4.35Å; T441-E444 PolarHBondContact N-OE2 2.7Å; T441-E444 PolarHBondContact O-N 3.03Å; T441-E444 PolarHBondContact OG1-N 2.99Å; E444-L447 PolarHBondContact O-N 3.47Å; E444-E448 WeakPolarHBondContact O-CG 3.48Å; E444-E448 PolarHBondContact O-N 3.46Å
445	H	96.4	Very high	93.1	Very high	8 Å²	8	70.8 Å²	70.8	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-65.3	-40.6	178	-179.3	-87.1	0	0	0	112.1	Y398 K440 T441 E448 T449	Y398-H445 WeakPolarHBondContact CB-NE2 3.41Å; Y398-H445 HydrophobicContact CD1-CB 4.18Å; Y398-H445 AromaticContact CD1-CG 3.79Å; Y398-H445 AromaticContact CD1-ND1 3.79Å; Y398-H445 HydrophobicContact CD2-CB 4.1Å; Y398-H445 AromaticContact CD2-CD2 3.59Å; Y398-H445 AromaticContact CD2-CG 3.79Å; Y398-H445 HydrophobicContact CE1-CB 4.1Å; Y398-H445 HydrophobicContact CE2-CB 4Å; Y398-H445 HydrophobicContact CG-CB 4.19Å; Y398-H445 AromaticContact CG-CD2 3.53Å; Y398-H445 AromaticContact CG-CE1 3.91Å; Y398-H445 AromaticContact CG-CG 3.57Å; Y398-H445 AromaticContact CG-ND1 3.81Å; Y398-H445 AromaticContact CG-NE2 3.76Å; K440-H445 HydrophobicContact CB-CB 4.47Å; T441-H445 PolarHBondContact O-N 3.41Å; H445-E448 PolarHBondContact O-N 3Å; H445-T449 PolarHBondContact CE1-OG1 2.96Å; H445-T449 VanDerWaalsContact CE1-OG1 3.22Å; H445-T449 PolarHBondContact ND1-OG1 2.95Å; H445-T449 WeakPolarHBondContact O-CB 3.44Å; H445-T449 PolarHBondContact O-N 3.34Å; H445-T449 PolarHBondContact O-OG1 2.92Å
446	E	97	Very high	94.9	Very high	68 Å²	68	71.8 Å²	71.8	32%	0.318	37%	0.374	S	S	.	.	H	α-helix	trans	-62.2	-43.1	174.9	-173.8	-176.9	127.4	0	0	111.4	P442 E443 G450 K452	P442-E446 VanDerWaalsContact O-CB 3.28Å; P442-E446 WeakPolarHBondContact O-CB 3.24Å; P442-E446 PolarHBondContact O-N 3.06Å; E443-E446 PolarHBondContact O-N 3.31Å; E446-G450 VanDerWaalsContact O-CA 3.22Å; E446-G450 WeakPolarHBondContact O-CA 3.42Å; E446-G450 PolarHBondContact O-N 3.47Å; E446-K452 HydrophobicContact CG-CG 4.23Å; E446-K452 IonicContact OE1-NZ 3.96Å; E446-K452 PolarHBondContact OE1-NZ 2.88Å; E446-K452 WeakPolarHBondContact OE2-CA 3.5Å; E446-K452 VanDerWaalsContact OE2-CG 3.27Å; E446-K452 WeakPolarHBondContact OE2-CG 3.47Å; E446-K452 IonicContact OE2-NZ 2.79Å; E446-K452 PolarHBondContact OE2-NZ 3.03Å
447	L	96.7	Very high	95.7	Very high	155 Å²	155	68 Å²	68	81%	0.812	35%	0.353	S	S	*	.	H	α-helix	trans	-66.9	-36.6	179.5	-174.5	148	0	0	0	112.6	E443 E444	E443-L447 VanDerWaalsContact O-CB 3.28Å; E443-L447 WeakPolarHBondContact O-CB 3.44Å; E443-L447 PolarHBondContact O-N 3.02Å; E444-L447 PolarHBondContact O-N 3.47Å
448	E	95.4	Very high	95.9	Very high	106 Å²	106	71.4 Å²	71.4	50%	0.495	37%	0.369	S	S	.	.	H	α-helix	trans	-75.3	-35.9	176.8	-75.8	-175.9	-133.2	0	0	114	K440 E444 H445	K440-E448 WeakPolarHBondContact CD-OE1 3.29Å; K440-E448 WeakPolarHBondContact CE-OE1 3.44Å; K440-E448 IonicContact NZ-OE1 3.49Å; K440-E448 PolarHBondContact NZ-OE1 3.25Å; K440-E448 IonicContact NZ-OE2 3.67Å; K440-E448 PolarHBondContact NZ-OE2 3.47Å; E444-E448 WeakPolarHBondContact O-CG 3.48Å; E444-E448 PolarHBondContact O-N 3.46Å; H445-E448 PolarHBondContact O-N 3Å
449	T	95.4	Very high	96.1	Very high	63 Å²	63	69.4 Å²	69.4	39%	0.387	36%	0.361	S	S	.	.	H	α-helix	trans	-115.5	-15.5	-167.1	68.1	0	0	0	0	115	H445 I451	H445-T449 PolarHBondContact CE1-OG1 2.96Å; H445-T449 VanDerWaalsContact CE1-OG1 3.22Å; H445-T449 PolarHBondContact ND1-OG1 2.95Å; H445-T449 WeakPolarHBondContact O-CB 3.44Å; H445-T449 PolarHBondContact O-N 3.34Å; H445-T449 PolarHBondContact O-OG1 2.92Å; T449-I451 PolarHBondContact O-N 3.18Å; T449-I451 WeakPolarHBondContact OG1-CB 3.48Å; T449-I451 PolarHBondContact OG1-N 3.06Å; T449-I451 VanDerWaalsContact OG1-N 3.12Å
450	G	96	Very high	96.1	Very high	62 Å²	62	71.9 Å²	71.9	64%	0.639	37%	0.374	S	S	*	.	S	Bend	trans	73.7	-3.3	-167.5	0	0	0	0	0	114.6	E446 K452	E446-G450 VanDerWaalsContact O-CA 3.22Å; E446-G450 WeakPolarHBondContact O-CA 3.42Å; E446-G450 PolarHBondContact O-N 3.47Å; G450-K452 PolarHBondContact O-N 3.43Å
451	I	93.9	Very high	96.1	Very high	85 Å²	85	72.1 Å²	72.1	44%	0.436	38%	0.375	S	S	.	.			trans	-89.4	107.3	-175.4	-56.2	174	0	0	0	109.6	T449 S453	T449-I451 PolarHBondContact O-N 3.18Å; T449-I451 WeakPolarHBondContact OG1-CB 3.48Å; T449-I451 PolarHBondContact OG1-N 3.06Å; T449-I451 VanDerWaalsContact OG1-N 3.12Å; I451-S453 PolarHBondContact O-N 3.12Å
452	K	95.3	Very high	96.1	Very high	127 Å²	127	75.8 Å²	75.8	55%	0.552	39%	0.393	S	S	*	.			trans	-63.2	127.7	172.6	-55.6	-158.2	153.3	-77.4	0	110.8	E446 G450	E446-K452 HydrophobicContact CG-CG 4.23Å; E446-K452 IonicContact OE1-NZ 3.96Å; E446-K452 PolarHBondContact OE1-NZ 2.88Å; E446-K452 WeakPolarHBondContact OE2-CA 3.5Å; E446-K452 VanDerWaalsContact OE2-CG 3.27Å; E446-K452 WeakPolarHBondContact OE2-CG 3.47Å; E446-K452 IonicContact OE2-NZ 2.79Å; E446-K452 PolarHBondContact OE2-NZ 3.03Å; G450-K452 PolarHBondContact O-N 3.43Å
453	S	95.4	Very high	96.1	Very high	30 Å²	30	75.9 Å²	75.9	21%	0.21	39%	0.394	C	S	.	.			trans	-66.8	142.3	171	-59.4	0	0	0	0	110.3	Y398 D399 P442 I451	Y398-S453 VanDerWaalsContact CE1-OG 3.29Å; Y398-S453 WeakPolarHBondContact CE1-OG 3.37Å; D399-S453 WeakPolarHBondContact OD1-CB 3.42Å; P442-S453 WeakPolarHBondContact CB-OG 3.33Å; I451-S453 PolarHBondContact O-N 3.12Å
454	K	94.7	Very high	96.1	Very high	129 Å²	129	70.3 Å²	70.3	56%	0.561	37%	0.368	S	S	*	.			trans	-118.7	153.5	175.6	-63.3	178.5	-176.6	173	0	109.7	A395 R402 Y403	A395-K454 HydrophobicContact CB-CB 3.98Å; A395-K454 HydrophobicContact CB-CD 4.01Å; A395-K454 HydrophobicContact CB-CG 4.31Å; R402-K454 PolarHBondContact NH2-O 3.41Å; Y403-K454 PolarHBondContact OH-O 2.99Å
455	E	96.3	Very high	96.2	Very high	95 Å²	95	71.1 Å²	71.1	44%	0.444	37%	0.374	S	S	.	.			trans	-108.3	125.9	166.4	-172.1	54	-109	0	0	109.1	R402 Y403 R457 I460	R402-E455 IonicContact NH1-OE2 2.8Å; R402-E455 PolarHBondContact NH1-OE2 2.8Å; Y403-E455 WeakPolarHBondContact CE1-OE1 3.21Å; Y403-E455 WeakPolarHBondContact CE1-OE2 3.21Å; Y403-E455 WeakPolarHBondContact OH-CA 3.21Å; Y403-E455 PolarHBondContact OH-OE1 3.15Å; E455-R457 WeakPolarHBondContact OE1-CB 3.36Å; E455-R457 IonicContact OE1-CZ 2.72Å; E455-R457 PolarHBondContact OE1-N 2.6Å; E455-R457 VanDerWaalsContact OE1-N 3.11Å; E455-R457 IonicContact OE1-NE 2.94Å; E455-R457 PolarHBondContact OE1-NE 2.85Å; E455-R457 IonicContact OE1-NH2 3.94Å; E455-R457 PolarHBondContact OE1-NH2 2.82Å; E455-R457 IonicContact OE2-CZ 3.07Å; E455-R457 IonicContact OE2-NE 3.81Å; E455-R457 IonicContact OE2-NH2 2.76Å; E455-R457 PolarHBondContact OE2-NH2 2.9Å; E455-I460 HydrophobicContact CG-CD1 4.29Å
456	A	96	Very high	96.2	Very high	39 Å²	39	73 Å²	73	32%	0.322	39%	0.385	S	S	.	.			trans	-136.6	0.1	-170.4	0	0	0	0	0	113	W389 P393 Y403	W389-A456 PolarHBondContact NE1-O 3.08Å; W389-A456 VanDerWaalsContact NE1-O 3.13Å; P393-A456 HydrophobicContact CB-CB 4.23Å; P393-A456 HydrophobicContact CG-CB 4Å; P393-A456 VanDerWaalsContact CG-O 3.29Å; P393-A456 WeakPolarHBondContact CG-O 3.47Å; Y403-A456 PolarHBondContact OH-N 2.83Å
457	R	97.5	Very high	96.1	Very high	21 Å²	21	69.8 Å²	69.8	8%	0.079	37%	0.37	C	S	.	.			trans	-76.7	125.1	175.1	-71.5	172.2	-67.1	-179.6	0.9	110.7	P393 Y403 Q406 E455 Y459 I460	P393-R457 HydrophobicContact CG-CG 3.86Å; Y403-R457 VanDerWaalsContact CD1-NE 3.29Å; Y403-R457 HydrophobicContact CD2-CG 4.15Å; Y403-R457 HydrophobicContact CE2-CG 4.03Å; Y403-R457 HydrophobicContact CG-CG 4.45Å; Q406-R457 VanDerWaalsContact OE1-CZ 3.31Å; E455-R457 WeakPolarHBondContact OE1-CB 3.36Å; E455-R457 IonicContact OE1-CZ 2.72Å; E455-R457 PolarHBondContact OE1-N 2.6Å; E455-R457 VanDerWaalsContact OE1-N 3.11Å; E455-R457 IonicContact OE1-NE 2.94Å; E455-R457 PolarHBondContact OE1-NE 2.85Å; E455-R457 IonicContact OE1-NH2 3.94Å; E455-R457 PolarHBondContact OE1-NH2 2.82Å; E455-R457 IonicContact OE2-CZ 3.07Å; E455-R457 IonicContact OE2-NE 3.81Å; E455-R457 IonicContact OE2-NH2 2.76Å; E455-R457 PolarHBondContact OE2-NH2 2.9Å; R457-Y459 WeakPolarHBondContact CB-O 3.32Å; R457-I460 HydrophobicContact CB-CG1 3.99Å
458	K	96.5	Very high	96	Very high	102 Å²	102	63.9 Å²	63.9	44%	0.443	34%	0.343	S	S	.	.	S	Bend	trans	-67.9	-26.8	164.1	-177.5	-175.4	171	-160.2	0	112.1	W389	W389-K458 HydrophobicContact CB-CB 4.18Å; W389-K458 HydrophobicContact CB-CD 3.86Å; W389-K458 VanDerWaalsContact CD1-CB 3.5Å; W389-K458 HydrophobicContact CD2-CB 3.87Å; W389-K458 HydrophobicContact CD2-CD 4.03Å; W389-K458 HydrophobicContact CE3-CD 4.19Å; W389-K458 HydrophobicContact CG-CB 3.57Å; W389-K458 HydrophobicContact CG-CD 3.9Å; W389-K458 HydrophobicContact CG-CG 4.42Å
459	Y	96.6	Very high	95.7	Very high	47 Å²	47	65.8 Å²	65.8	18%	0.184	35%	0.352	C	S	.	.			trans	-131.2	122.4	179.5	-57.2	-83.7	0	0	0	110	L387 W389 R457 F461	L387-Y459 HydrophobicContact CB-CD2 4.1Å; L387-Y459 HydrophobicContact CB-CE2 3.93Å; L387-Y459 HydrophobicContact CD1-CD2 4.27Å; L387-Y459 HydrophobicContact CD2-CD2 4.02Å; L387-Y459 HydrophobicContact CD2-CE2 4.17Å; L387-Y459 HydrophobicContact CD2-CG 4.32Å; L387-Y459 HydrophobicContact CG-CD2 4.36Å; L387-Y459 WeakPolarHBondContact O-CE2 3.35Å; W389-Y459 HydrophobicContact CB-CE2 4.38Å; R457-Y459 WeakPolarHBondContact CB-O 3.32Å; Y459-F461 HydrophobicContact CD1-CZ 4.29Å; Y459-F461 HydrophobicContact CG-CE2 4.37Å; Y459-F461 HydrophobicContact CG-CZ 4.05Å
460	I	96.8	Very high	95.6	Very high	88 Å²	88	64.3 Å²	64.3	45%	0.451	34%	0.343	S	S	.	.			trans	-109	117.1	174.4	-58	178.9	0	0	0	107.3	E455 R457	E455-I460 HydrophobicContact CG-CD1 4.29Å; R457-I460 HydrophobicContact CB-CG1 3.99Å
461	F	96.7	Very high	95.1	Very high	11 Å²	11	65.2 Å²	65.2	5%	0.048	33%	0.333	C	S	.	.			trans	-109.4	141.9	-179.5	-59.4	-66.1	0	0	0	110.3	L387 L391 T407 Y459 D466 M467 V470	L387-F461 HydrophobicContact CD1-CE2 4Å; L387-F461 HydrophobicContact CD2-CE2 4.17Å; L387-F461 HydrophobicContact CD2-CZ 3.89Å; L391-F461 HydrophobicContact CD1-CD2 4.12Å; L391-F461 HydrophobicContact CD1-CE2 4.2Å; T407-F461 WeakPolarHBondContact CB-O 3.44Å; T407-F461 HydrophobicContact CG2-CB 3.85Å; T407-F461 PolarHBondContact OG1-O 2.65Å; Y459-F461 HydrophobicContact CD1-CZ 4.29Å; Y459-F461 HydrophobicContact CG-CE2 4.37Å; Y459-F461 HydrophobicContact CG-CZ 4.05Å; F461-D466 HydrophobicContact CB-CB 4.28Å; F461-D466 HydrophobicContact CD1-CB 3.63Å; F461-D466 HydrophobicContact CE1-CB 4.42Å; F461-D466 HydrophobicContact CG-CB 4.35Å; F461-M467 HydrophobicContact CD1-CG 4.12Å; F461-M467 HydrophobicContact CD2-CG 3.7Å; F461-M467 HydrophobicContact CD2-SD 4.23Å; F461-M467 HydrophobicContact CE1-CG 3.93Å; F461-M467 HydrophobicContact CE2-CG 3.51Å; F461-M467 HydrophobicContact CE2-SD 4.14Å; F461-M467 HydrophobicContact CG-CG 4Å; F461-M467 HydrophobicContact CZ-CG 3.62Å; F461-V470 HydrophobicContact CE1-CG1 3.72Å; F461-V470 HydrophobicContact CE1-CG2 4.5Å; F461-V470 HydrophobicContact CZ-CG1 4.13Å; F461-V470 HydrophobicContact CZ-CG2 4.24Å
462	N	95.8	Very high	94.5	Very high	132 Å²	132	64.5 Å²	64.5	71%	0.706	33%	0.328	S	S	*	.	S	Bend	trans	-80.4	-33.4	173.1	-56	-59.4	0	0	0	110.3	D466	N462-D466 WeakPolarHBondContact CA-OD2 3.45Å; N462-D466 WeakPolarHBondContact CB-OD2 3.39Å; N462-D466 PolarHBondContact N-OD2 3.12Å
463	C	97.1	Very high	93.8	Very high	44 Å²	44	61.4 Å²	61.4	30%	0.297	32%	0.323	S	S	.	.	S	Bend	trans	-143.6	158.5	172.3	69.2	0	0	0	0	111.2	T407 D465 D466	T407-C463 WeakPolarHBondContact O-CA 3.42Å; C463-D465 PolarHBondContact O-N 3.49Å; C463-D465 VanDerWaalsContact O-N 3.13Å; C463-D466 PolarHBondContact N-OD2 1.8Å; C463-D466 WeakPolarHBondContact O-CB 3.28Å; C463-D466 PolarHBondContact O-N 3.03Å; C463-D466 VanDerWaalsContact O-N 3.13Å; C463-D466 VanDerWaalsContact SG-CG 3.59Å; C463-D466 PolarHBondContact SG-OD1 3.07Å; C463-D466 VanDerWaalsContact SG-OD1 3.4Å
464	L	97.6	Very high	92.9	Very high	8 Å²	8	66 Å²	66	4%	0.042	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-62.4	-17.5	175	-69.5	175.6	0	0	0	113.4	L391 T407 Q408 D466 M467 I492 K496 L499	L391-L464 HydrophobicContact CD2-CD2 4.13Å; T407-L464 HydrophobicContact CG2-CD2 3.95Å; T407-L464 HydrophobicContact CG2-CG 4.29Å; Q408-L464 HydrophobicContact CG-CD1 4.1Å; Q408-L464 HydrophobicContact CG-CG 4.21Å; L464-D466 VanDerWaalsContact C-N 3.33Å; L464-M467 HydrophobicContact CD2-SD 3.77Å; L464-M467 WeakPolarHBondContact O-CB 3.22Å; L464-M467 PolarHBondContact O-N 2.81Å; L464-I492 WeakPolarHBondContact O-CG2 3.31Å; L464-K496 HydrophobicContact CB-CD 4.12Å; L464-K496 HydrophobicContact CB-CG 3.69Å; L464-K496 HydrophobicContact CD1-CG 3.76Å; L464-K496 HydrophobicContact CG-CG 4.38Å; L464-L499 HydrophobicContact CD1-CB 4.11Å; L464-L499 HydrophobicContact CD1-CD1 4.06Å; L464-L499 HydrophobicContact CD2-CD1 4.17Å
465	D	97.4	Very high	92.1	Very high	73 Å²	73	66.1 Å²	66.1	39%	0.39	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-72.6	-24.2	175.9	-54	-82.7	0	0	0	113.1	C463 M467 A468 K496	C463-D465 PolarHBondContact O-N 3.49Å; C463-D465 VanDerWaalsContact O-N 3.13Å; D465-M467 PolarHBondContact O-N 3.22Å; D465-A468 VanDerWaalsContact O-CB 3.22Å; D465-A468 WeakPolarHBondContact O-CB 3.28Å; D465-A468 PolarHBondContact O-N 2.92Å; D465-K496 WeakPolarHBondContact OD1-CD 3.38Å; D465-K496 IonicContact OD1-NZ 3.47Å; D465-K496 PolarHBondContact OD1-NZ 3.06Å; D465-K496 IonicContact OD2-NZ 3.7Å; D465-K496 PolarHBondContact OD2-NZ 2.68Å
466	D	96.2	Very high	91.4	Very high	49 Å²	49	64.3 Å²	64.3	26%	0.262	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-59.3	-32	174.1	-61.3	-32.2	0	0	0	111.5	F461 N462 C463 L464 A468 Q469	F461-D466 HydrophobicContact CB-CB 4.28Å; F461-D466 HydrophobicContact CD1-CB 3.63Å; F461-D466 HydrophobicContact CE1-CB 4.42Å; F461-D466 HydrophobicContact CG-CB 4.35Å; N462-D466 WeakPolarHBondContact CA-OD2 3.45Å; N462-D466 WeakPolarHBondContact CB-OD2 3.39Å; N462-D466 PolarHBondContact N-OD2 3.12Å; C463-D466 PolarHBondContact N-OD2 1.8Å; C463-D466 WeakPolarHBondContact O-CB 3.28Å; C463-D466 PolarHBondContact O-N 3.03Å; C463-D466 VanDerWaalsContact O-N 3.13Å; C463-D466 VanDerWaalsContact SG-CG 3.59Å; C463-D466 PolarHBondContact SG-OD1 3.07Å; C463-D466 VanDerWaalsContact SG-OD1 3.4Å; L464-D466 VanDerWaalsContact C-N 3.33Å; D466-A468 PolarHBondContact O-N 3.26Å; D466-A468 VanDerWaalsContact O-N 3.17Å; D466-Q469 PolarHBondContact O-N 3.14Å; D466-Q469 VanDerWaalsContact O-N 3.1Å
467	M	96.1	Very high	90.7	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-61.9	-21.4	177.2	-65.7	178.8	60.3	0	0	112.9	A383 F386 L387 L391 F461 L464 D465 Q469 I492 L495	A383-M467 HydrophobicContact CB-CE 4.03Å; F386-M467 HydrophobicContact CD1-CE 3.99Å; F386-M467 HydrophobicContact CE1-CB 4.33Å; F386-M467 HydrophobicContact CE1-CE 4.33Å; F386-M467 WeakPolarHBondContact CE1-O 3.27Å; L387-M467 HydrophobicContact CD1-CE 4.05Å; L387-M467 HydrophobicContact CD2-CE 4.37Å; L387-M467 HydrophobicContact CG-CE 4.21Å; L391-M467 HydrophobicContact CD1-CE 4.37Å; L391-M467 HydrophobicContact CD1-SD 3.87Å; F461-M467 HydrophobicContact CD1-CG 4.12Å; F461-M467 HydrophobicContact CD2-CG 3.7Å; F461-M467 HydrophobicContact CD2-SD 4.23Å; F461-M467 HydrophobicContact CE1-CG 3.93Å; F461-M467 HydrophobicContact CE2-CG 3.51Å; F461-M467 HydrophobicContact CE2-SD 4.14Å; F461-M467 HydrophobicContact CG-CG 4Å; F461-M467 HydrophobicContact CZ-CG 3.62Å; L464-M467 HydrophobicContact CD2-SD 3.77Å; L464-M467 WeakPolarHBondContact O-CB 3.22Å; L464-M467 PolarHBondContact O-N 2.81Å; D465-M467 PolarHBondContact O-N 3.22Å; M467-Q469 PolarHBondContact O-N 3.4Å; M467-Q469 VanDerWaalsContact O-N 3.09Å; M467-I492 HydrophobicContact CB-CD1 3.57Å; M467-L495 HydrophobicContact CE-CD2 3.57Å; M467-L495 HydrophobicContact SD-CD2 3.86Å
468	A	93.6	Very high	90.2	Very high	30 Å²	30	71.9 Å²	71.9	25%	0.248	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-60.4	-20.6	175.1	0	0	0	0	0	112.5	D465 D466 R488 I492	D465-A468 VanDerWaalsContact O-CB 3.22Å; D465-A468 WeakPolarHBondContact O-CB 3.28Å; D465-A468 PolarHBondContact O-N 2.92Å; D466-A468 PolarHBondContact O-N 3.26Å; D466-A468 VanDerWaalsContact O-N 3.17Å; A468-R488 PolarHBondContact O-NE 3.5Å; A468-R488 PolarHBondContact O-NH2 2.54Å; A468-I492 HydrophobicContact CB-CG1 4.18Å
469	Q	89.7	Confident	89.9	Confident	147 Å²	147	70.6 Å²	70.6	69%	0.687	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-22.8	-172.7	-53.7	-171.3	29.6	0	0	114.7	D466 M467	D466-Q469 PolarHBondContact O-N 3.14Å; D466-Q469 VanDerWaalsContact O-N 3.1Å; M467-Q469 PolarHBondContact O-N 3.4Å; M467-Q469 VanDerWaalsContact O-N 3.09Å
470	V	91.6	Very high	89.6	Confident	32 Å²	32	69.5 Å²	69.5	19%	0.194	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	141.4	-173.8	-62.4	0	0	0	0	113.7	F386 L387 F461 M472 R488	F386-V470 HydrophobicContact CE1-CG2 4.18Å; L387-V470 HydrophobicContact CD2-CG2 3.77Å; F461-V470 HydrophobicContact CE1-CG1 3.72Å; F461-V470 HydrophobicContact CE1-CG2 4.5Å; F461-V470 HydrophobicContact CZ-CG1 4.13Å; F461-V470 HydrophobicContact CZ-CG2 4.24Å; V470-M472 PolarHBondContact O-N 3.19Å; V470-R488 PolarHBondContact O-NH2 3.25Å
471	N	85.8	Confident	89.4	Confident	80 Å²	80	68.6 Å²	68.6	43%	0.428	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.2	24.2	175.9	-42	-42.3	0	0	0	114.7	P286	P286-N471 HydrophobicContact CB-CB 4.24Å; P286-N471 HydrophobicContact CG-CB 4.06Å; P286-N471 VanDerWaalsContact CG-ND2 3.27Å; P286-N471 WeakPolarHBondContact CG-ND2 3.49Å
472	M	82.8	Confident	89.2	Confident	70 Å²	70	72.5 Å²	72.5	35%	0.345	41%	0.407	S	S	.	.			trans	-66	136.6	167.6	-84.9	-157.3	-78.1	0	0	110.5	V470 K485 R488	V470-M472 PolarHBondContact O-N 3.19Å; M472-K485 HydrophobicContact SD-CG 3.99Å; M472-R488 VanDerWaalsContact CG-NE 3.26Å
473	S	79.9	Confident	89.1	Confident	62 Å²	62	66.2 Å²	66.2	43%	0.434	37%	0.373	S	S	.	.			trans	-71	132.5	171.4	174.3	0	0	0	0	110.3	D475	S473-D475 PolarHBondContact OG-N 3Å; S473-D475 VanDerWaalsContact OG-N 3.15Å
474	T	77.1	Confident	88.9	Confident	128 Å²	128	65.2 Å²	65.2	79%	0.785	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-15.5	171.8	39.8	0	0	0	0	113.5	L476	T474-L476 VanDerWaalsContact C-N 3.34Å
475	D	77.8	Confident	88.8	Confident	131 Å²	131	69.1 Å²	69.1	70%	0.701	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	4.5	-163.3	-37.3	-31.6	0	0	0	111.6	S473	S473-D475 PolarHBondContact OG-N 3Å; S473-D475 VanDerWaalsContact OG-N 3.15Å
476	L	81.2	Confident	88.7	Confident	56 Å²	56	65.8 Å²	65.8	29%	0.293	36%	0.363	S	S	.	.			trans	-90.8	117	175	-62.3	177.4	0	0	0	109.7	T474 D480 M481 E484	T474-L476 VanDerWaalsContact C-N 3.34Å; L476-D480 HydrophobicContact CD2-CB 4.42Å; L476-M481 HydrophobicContact CB-CB 4.09Å; L476-M481 WeakPolarHBondContact O-CB 3.08Å; L476-E484 HydrophobicContact CD1-CB 4.03Å; L476-E484 HydrophobicContact CD1-CG 4.07Å
477	E	81.1	Confident	88.7	Confident	169 Å²	169	63.4 Å²	63.4	79%	0.79	35%	0.35	S	S	*	.			trans	-103.4	161.5	176	-64.7	-167.4	159.5	0	0	112.5	T479 D480	E477-T479 PolarHBondContact O-N 3.32Å; E477-D480 PolarHBondContact O-N 3Å
478	G	87.6	Confident	88.8	Confident	50 Å²	50	63.9 Å²	63.9	52%	0.515	35%	0.352	S	S	.	.	H	α-helix	trans	53.4	-126.1	169.2	0	0	0	0	0	115	L482	G478-L482 PolarHBondContact O-N 3.35Å
479	T	89.6	Confident	89	Confident	75 Å²	75	69.2 Å²	69.2	46%	0.46	37%	0.366	S	S	.	.	H	α-helix	trans	-71	-27.6	-174.7	48.4	0	0	0	0	113.8	E477 L482 A483	E477-T479 PolarHBondContact O-N 3.32Å; T479-L482 PolarHBondContact O-N 2.79Å; T479-A483 WeakPolarHBondContact O-CB 3.5Å; T479-A483 PolarHBondContact O-N 3.05Å
480	D	91	Very high	89.4	Confident	25 Å²	25	63.2 Å²	63.2	13%	0.134	34%	0.338	C	S	.	.	H	α-helix	trans	-68.7	-37.7	177.9	-84.3	-39.6	0	0	0	111.3	L476 E477 A483 E484 S529 N530 H531	L476-D480 HydrophobicContact CD2-CB 4.42Å; E477-D480 PolarHBondContact O-N 3Å; D480-A483 PolarHBondContact O-N 2.95Å; D480-E484 PolarHBondContact O-N 3.3Å; D480-S529 VanDerWaalsContact OD1-CA 3.31Å; D480-S529 WeakPolarHBondContact OD1-CA 3.3Å; D480-S529 VanDerWaalsContact OD1-CB 3.26Å; D480-S529 WeakPolarHBondContact OD1-CB 3.3Å; D480-S529 PolarHBondContact OD1-OG 2.89Å; D480-N530 PolarHBondContact OD1-N 3.36Å; D480-N530 PolarHBondContact OD2-N 3.23Å; D480-N530 PolarHBondContact OD2-ND2 2.81Å; D480-H531 PolarHBondContact OD1-N 3.22Å
481	M	91.4	Very high	89.7	Confident	69 Å²	69	61.7 Å²	61.7	34%	0.34	33%	0.328	S	S	.	.	H	α-helix	trans	-66.3	-37.5	171.1	170.5	174.6	46	0	0	112.9	L476 K485	L476-M481 HydrophobicContact CB-CB 4.09Å; L476-M481 WeakPolarHBondContact O-CB 3.08Å; M481-K485 HydrophobicContact CG-CD 3.89Å; M481-K485 HydrophobicContact CG-CG 4.49Å; M481-K485 WeakPolarHBondContact O-CB 3.41Å; M481-K485 VanDerWaalsContact O-CG 3.29Å; M481-K485 WeakPolarHBondContact O-CG 3.3Å; M481-K485 PolarHBondContact O-N 2.85Å; M481-K485 PolarHBondContact SD-NZ 2.73Å
482	L	92.8	Very high	90.3	Very high	93 Å²	93	58 Å²	58	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-67.7	-39.7	177.5	-67.9	174.4	0	0	0	111.4	G478 T479 K485 A486 F526	G478-L482 PolarHBondContact O-N 3.35Å; T479-L482 PolarHBondContact O-N 2.79Å; L482-K485 PolarHBondContact O-N 3.27Å; L482-A486 PolarHBondContact O-N 2.64Å; L482-F526 HydrophobicContact CB-CD1 4.26Å; L482-F526 HydrophobicContact CB-CE1 3.68Å; L482-F526 HydrophobicContact CB-CZ 4.32Å
483	A	94.3	Very high	91.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-49.4	174.9	0	0	0	0	0	112.1	T479 D480 K485 A486 D487 L523 F526 V532	T479-A483 WeakPolarHBondContact O-CB 3.5Å; T479-A483 PolarHBondContact O-N 3.05Å; D480-A483 PolarHBondContact O-N 2.95Å; A483-K485 VanDerWaalsContact C-N 3.32Å; A483-K485 PolarHBondContact O-N 2.89Å; A483-A486 WeakPolarHBondContact O-CB 3.44Å; A483-A486 PolarHBondContact O-N 3.31Å; A483-A486 VanDerWaalsContact O-N 3.09Å; A483-D487 WeakPolarHBondContact O-CB 3.38Å; A483-D487 PolarHBondContact O-N 2.76Å; A483-L523 HydrophobicContact CB-CD2 4.46Å; A483-F526 HydrophobicContact CB-CB 4.07Å; A483-F526 HydrophobicContact CB-CD2 4.12Å; A483-F526 HydrophobicContact CB-CG 3.99Å; A483-V532 HydrophobicContact CB-CG2 3.83Å
484	E	93.6	Very high	92	Very high	23 Å²	23	54.1 Å²	54.1	11%	0.107	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-39.3	175.2	172.5	66.7	-167.4	0	0	111.3	L476 D480 A486 D487 R488 H531	L476-E484 HydrophobicContact CD1-CB 4.03Å; L476-E484 HydrophobicContact CD1-CG 4.07Å; D480-E484 PolarHBondContact O-N 3.3Å; E484-A486 VanDerWaalsContact C-N 3.32Å; E484-A486 PolarHBondContact O-N 3.1Å; E484-D487 PolarHBondContact O-N 3.07Å; E484-R488 HydrophobicContact CG-CG 4.37Å; E484-R488 WeakPolarHBondContact O-CB 3.44Å; E484-R488 WeakPolarHBondContact O-CD 3.15Å; E484-R488 WeakPolarHBondContact O-CG 3.41Å; E484-R488 PolarHBondContact O-N 3Å; E484-R488 WeakPolarHBondContact OE1-CD 3.37Å; E484-R488 WeakPolarHBondContact OE1-CG 3.36Å; E484-R488 IonicContact OE1-CZ 2.56Å; E484-R488 IonicContact OE1-NE 2.63Å; E484-R488 IonicContact OE1-NH1 2.73Å; E484-R488 PolarHBondContact OE1-NH1 3.5Å; E484-R488 VanDerWaalsContact OE1-NH1 3.07Å; E484-H531 IonicContact OE2-CE1 2.67Å; E484-H531 PolarHBondContact OE2-CE1 3.18Å; E484-H531 IonicContact OE2-ND1 3.99Å; E484-H531 IonicContact OE2-NE2 2.78Å; E484-H531 PolarHBondContact OE2-NE2 3.13Å
485	K	94.6	Very high	93	Very high	90 Å²	90	48 Å²	48	39%	0.391	25%	0.247	S	C	.	.	H	α-helix	trans	-67.1	-27.9	174.4	-76.5	172.8	177.9	171.9	0	113.8	M472 M481 L482 A483 R489	M472-K485 HydrophobicContact SD-CG 3.99Å; M481-K485 HydrophobicContact CG-CD 3.89Å; M481-K485 HydrophobicContact CG-CG 4.49Å; M481-K485 WeakPolarHBondContact O-CB 3.41Å; M481-K485 VanDerWaalsContact O-CG 3.29Å; M481-K485 WeakPolarHBondContact O-CG 3.3Å; M481-K485 PolarHBondContact O-N 2.85Å; M481-K485 PolarHBondContact SD-NZ 2.73Å; L482-K485 PolarHBondContact O-N 3.27Å; A483-K485 VanDerWaalsContact C-N 3.32Å; A483-K485 PolarHBondContact O-N 2.89Å; K485-R489 PolarHBondContact O-NH1 2.82Å
486	A	95.9	Very high	94	Very high	2 Å²	2	45.4 Å²	45.4	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-74.4	-44.6	170.9	0	0	0	0	0	111.3	L482 A483 E484 R488 R489 E490 F526	L482-A486 PolarHBondContact O-N 2.64Å; A483-A486 WeakPolarHBondContact O-CB 3.44Å; A483-A486 PolarHBondContact O-N 3.31Å; A483-A486 VanDerWaalsContact O-N 3.09Å; E484-A486 VanDerWaalsContact C-N 3.32Å; E484-A486 PolarHBondContact O-N 3.1Å; A486-R488 PolarHBondContact O-N 3.15Å; A486-R489 WeakPolarHBondContact O-CB 3.41Å; A486-R489 PolarHBondContact O-N 3.35Å; A486-R489 VanDerWaalsContact O-N 3.12Å; A486-E490 PolarHBondContact O-N 2.68Å; A486-F526 HydrophobicContact CB-CE2 3.86Å; A486-F526 HydrophobicContact CB-CZ 4.34Å
487	D	96.2	Very high	94.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57	-48.2	178.6	-157.5	-5.9	0	0	0	112.2	L289 R293 A483 E484 R489 E490 Y491 F517 H522 L523 H531	L289-D487 HydrophobicContact CD1-CB 4.2Å; R293-D487 IonicContact CZ-OD1 2.99Å; R293-D487 IonicContact CZ-OD2 3.03Å; R293-D487 IonicContact NH2-OD1 2.81Å; R293-D487 PolarHBondContact NH2-OD1 3.37Å; R293-D487 IonicContact NH2-OD2 3.93Å; R293-D487 PolarHBondContact NH2-OD2 3.39Å; A483-D487 WeakPolarHBondContact O-CB 3.38Å; A483-D487 PolarHBondContact O-N 2.76Å; E484-D487 PolarHBondContact O-N 3.07Å; D487-R489 VanDerWaalsContact C-N 3.29Å; D487-R489 PolarHBondContact O-N 2.83Å; D487-E490 PolarHBondContact O-N 3.01Å; D487-Y491 VanDerWaalsContact O-CB 3.3Å; D487-Y491 WeakPolarHBondContact O-CB 3.19Å; D487-Y491 PolarHBondContact O-N 3.33Å; D487-F517 VanDerWaalsContact OD1-CD2 3.31Å; D487-F517 WeakPolarHBondContact OD1-CD2 3.5Å; D487-F517 WeakPolarHBondContact OD1-CE2 3.39Å; D487-H522 WeakPolarHBondContact CA-NE2 3.25Å; D487-H522 IonicContact OD1-NE2 3.41Å; D487-L523 HydrophobicContact CB-CD2 4.25Å; D487-H531 IonicContact OD2-CE1 3.49Å; D487-H531 IonicContact OD2-NE2 3.6Å; D487-H531 PolarHBondContact OD2-NE2 2.93Å
488	R	97.1	Very high	95.7	Very high	9 Å²	9	38.7 Å²	38.7	3%	0.034	20%	0.195	C	C	.	.	H	α-helix	trans	-63.7	-31.3	177.3	-64.5	167.4	79.8	81.7	6.6	113.2	L289 A468 V470 M472 E484 A486 I492	L289-R488 HydrophobicContact CD1-CB 4.21Å; L289-R488 HydrophobicContact CD1-CG 3.53Å; A468-R488 PolarHBondContact O-NE 3.5Å; A468-R488 PolarHBondContact O-NH2 2.54Å; V470-R488 PolarHBondContact O-NH2 3.25Å; M472-R488 VanDerWaalsContact CG-NE 3.26Å; E484-R488 HydrophobicContact CG-CG 4.37Å; E484-R488 WeakPolarHBondContact O-CB 3.44Å; E484-R488 WeakPolarHBondContact O-CD 3.15Å; E484-R488 WeakPolarHBondContact O-CG 3.41Å; E484-R488 PolarHBondContact O-N 3Å; E484-R488 WeakPolarHBondContact OE1-CD 3.37Å; E484-R488 WeakPolarHBondContact OE1-CG 3.36Å; E484-R488 IonicContact OE1-CZ 2.56Å; E484-R488 IonicContact OE1-NE 2.63Å; E484-R488 IonicContact OE1-NH1 2.73Å; E484-R488 PolarHBondContact OE1-NH1 3.5Å; E484-R488 VanDerWaalsContact OE1-NH1 3.07Å; A486-R488 PolarHBondContact O-N 3.15Å; R488-I492 WeakPolarHBondContact O-CB 3.38Å; R488-I492 VanDerWaalsContact O-CG1 3.28Å; R488-I492 WeakPolarHBondContact O-CG1 3.13Å; R488-I492 PolarHBondContact O-N 2.94Å
489	R	97.6	Very high	96.2	Very high	142 Å²	142	36.3 Å²	36.3	54%	0.536	17%	0.171	S	C	.	.	H	α-helix	trans	-69.4	-49.8	176.4	174.9	176.7	57.8	-105.1	3.2	111.2	K485 A486 D487 Y491 I492 D493	K485-R489 PolarHBondContact O-NH1 2.82Å; A486-R489 WeakPolarHBondContact O-CB 3.41Å; A486-R489 PolarHBondContact O-N 3.35Å; A486-R489 VanDerWaalsContact O-N 3.12Å; D487-R489 VanDerWaalsContact C-N 3.29Å; D487-R489 PolarHBondContact O-N 2.83Å; R489-Y491 VanDerWaalsContact C-N 3.29Å; R489-Y491 PolarHBondContact O-N 3.05Å; R489-I492 PolarHBondContact O-N 3.42Å; R489-D493 WeakPolarHBondContact O-CB 3.28Å; R489-D493 PolarHBondContact O-N 3.36Å
490	E	98.1	Very high	96.7	Very high	21 Å²	21	34.5 Å²	34.5	10%	0.098	16%	0.159	C	C	.	.	H	α-helix	trans	-67.6	-32.4	178.6	-57.5	-50.8	121.5	0	0	111.7	A486 D487 L494 H515 Q516 F517 H522	A486-E490 PolarHBondContact O-N 2.68Å; D487-E490 PolarHBondContact O-N 3.01Å; E490-L494 WeakPolarHBondContact O-CB 3.41Å; E490-L494 PolarHBondContact O-N 2.79Å; E490-H515 VanDerWaalsContact CA-CE1 3.41Å; E490-H515 WeakPolarHBondContact CA-CE1 3.36Å; E490-H515 PolarHBondContact O-CE1 2.96Å; E490-H515 IonicContact OE2-CE1 3.07Å; E490-Q516 HydrophobicContact CB-CB 4.4Å; E490-Q516 HydrophobicContact CG-CB 4.09Å; E490-Q516 WeakPolarHBondContact OE2-CB 3.47Å; E490-Q516 PolarHBondContact OE2-NE2 2.93Å; E490-F517 HydrophobicContact CB-CB 4.01Å; E490-H522 HydrophobicContact CG-CB 3.8Å; E490-H522 VanDerWaalsContact CG-CG 3.45Å
491	Y	98.6	Very high	97	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.7	-49.6	170.5	171.7	-108.8	0	0	0	112.5	L289 I382 A383 F386 D487 R489 L494 L495 F517	L289-Y491 HydrophobicContact CD1-CG 4.31Å; L289-Y491 HydrophobicContact CD2-CD1 3.69Å; L289-Y491 HydrophobicContact CD2-CD2 3.54Å; L289-Y491 HydrophobicContact CD2-CE1 4.05Å; L289-Y491 HydrophobicContact CD2-CE2 3.91Å; L289-Y491 HydrophobicContact CD2-CG 3.42Å; L289-Y491 VanDerWaalsContact CD2-CG 3.42Å; I382-Y491 VanDerWaalsContact C-OH 3.26Å; I382-Y491 HydrophobicContact CB-CE2 4.3Å; I382-Y491 HydrophobicContact CD1-CE2 3.91Å; I382-Y491 HydrophobicContact CG1-CE2 4.1Å; I382-Y491 PolarHBondContact O-OH 3.31Å; A383-Y491 WeakPolarHBondContact CA-OH 3.36Å; A383-Y491 PolarHBondContact N-OH 2.96Å; F386-Y491 HydrophobicContact CB-CE1 4.2Å; F386-Y491 VanDerWaalsContact CB-OH 3.32Å; F386-Y491 WeakPolarHBondContact CB-OH 3.33Å; F386-Y491 AromaticContact CD1-CE1 3.79Å; F386-Y491 HydrophobicContact CD1-CE1 3.79Å; F386-Y491 HydrophobicContact CD2-CD1 4.32Å; F386-Y491 AromaticContact CD2-CE1 3.76Å; F386-Y491 HydrophobicContact CD2-CE1 3.76Å; F386-Y491 AromaticContact CE1-CE1 3.98Å; F386-Y491 HydrophobicContact CE1-CE1 3.98Å; F386-Y491 HydrophobicContact CE2-CD1 4.15Å; F386-Y491 AromaticContact CE2-CE1 3.94Å; F386-Y491 HydrophobicContact CE2-CE1 3.94Å; F386-Y491 AromaticContact CG-CE1 3.66Å; F386-Y491 HydrophobicContact CG-CE1 3.66Å; F386-Y491 AromaticContact CG-CZ 3.92Å; F386-Y491 HydrophobicContact CZ-CD1 4.29Å; F386-Y491 HydrophobicContact CZ-CE1 4.03Å; D487-Y491 VanDerWaalsContact O-CB 3.3Å; D487-Y491 WeakPolarHBondContact O-CB 3.19Å; D487-Y491 PolarHBondContact O-N 3.33Å; R489-Y491 VanDerWaalsContact C-N 3.29Å; R489-Y491 PolarHBondContact O-N 3.05Å; Y491-L494 PolarHBondContact O-N 3.04Å; Y491-L495 HydrophobicContact CE1-CD2 4.37Å; Y491-L495 WeakPolarHBondContact O-CB 3.19Å; Y491-L495 PolarHBondContact O-N 3.42Å; Y491-F517 HydrophobicContact CD2-CE1 4.08Å; Y491-F517 HydrophobicContact CD2-CE2 4.08Å; Y491-F517 AromaticContact CD2-CZ 3.84Å; Y491-F517 HydrophobicContact CD2-CZ 3.84Å; Y491-F517 HydrophobicContact CG-CE2 4.29Å; Y491-F517 HydrophobicContact CG-CZ 4.48Å
492	I	98.5	Very high	97.4	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-70.4	-36.5	-178.9	-69.6	-56.2	0	0	0	112.2	L464 M467 A468 R488 R489 L495 K496	L464-I492 WeakPolarHBondContact O-CG2 3.31Å; M467-I492 HydrophobicContact CB-CD1 3.57Å; A468-I492 HydrophobicContact CB-CG1 4.18Å; R488-I492 WeakPolarHBondContact O-CB 3.38Å; R488-I492 VanDerWaalsContact O-CG1 3.28Å; R488-I492 WeakPolarHBondContact O-CG1 3.13Å; R488-I492 PolarHBondContact O-N 2.94Å; R489-I492 PolarHBondContact O-N 3.42Å; I492-L495 HydrophobicContact CD1-CD2 3.99Å; I492-L495 PolarHBondContact O-N 3.48Å; I492-K496 HydrophobicContact CG2-CD 3.89Å; I492-K496 HydrophobicContact CG2-CG 4.47Å; I492-K496 WeakPolarHBondContact O-CB 3.23Å; I492-K496 WeakPolarHBondContact O-CG 3.42Å; I492-K496 PolarHBondContact O-N 3.34Å
493	D	98.8	Very high	97.6	Very high	50 Å²	50	28.3 Å²	28.3	27%	0.267	13%	0.131	S	C	.	.	H	α-helix	trans	-59.9	-44.6	170.7	171.3	64.8	0	0	0	111.6	R489 K496 K497 H515	R489-D493 WeakPolarHBondContact O-CB 3.28Å; R489-D493 PolarHBondContact O-N 3.36Å; D493-K496 PolarHBondContact O-N 2.89Å; D493-K497 WeakPolarHBondContact O-CB 3.44Å; D493-K497 WeakPolarHBondContact O-CD 3.24Å; D493-K497 VanDerWaalsContact O-CG 3.25Å; D493-K497 WeakPolarHBondContact O-CG 3.32Å; D493-K497 PolarHBondContact O-N 2.73Å; D493-K497 VanDerWaalsContact O-N 3.12Å; D493-K497 WeakPolarHBondContact OD1-CE 3.31Å; D493-K497 IonicContact OD1-NZ 3.95Å; D493-K497 PolarHBondContact OD1-NZ 2.9Å; D493-K497 WeakPolarHBondContact OD2-CE 3.28Å; D493-K497 IonicContact OD2-NZ 2.73Å; D493-K497 PolarHBondContact OD2-NZ 3.4Å; D493-H515 IonicContact OD1-NE2 2.69Å; D493-H515 IonicContact OD2-CD2 2.62Å; D493-H515 IonicContact OD2-CE1 3.61Å; D493-H515 PolarHBondContact OD2-CE1 3.28Å; D493-H515 CovalentContact OD2-NE2 1.8Å; D493-H515 IonicContact OD2-NE2 2.69Å; D493-H515 PolarHBondContact OD2-NE2 3.36Å
494	L	98.9	Very high	97.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-42.6	173.8	-176.6	52	0	0	0	112.4	L296 E490 Y491 K496 K497 M498 I507 T512 H515 F517 V518	L296-L494 HydrophobicContact CD2-CD2 3.77Å; E490-L494 WeakPolarHBondContact O-CB 3.41Å; E490-L494 PolarHBondContact O-N 2.79Å; Y491-L494 PolarHBondContact O-N 3.04Å; L494-K496 PolarHBondContact O-N 3.49Å; L494-K497 CarbonylContact O-C 3.3Å; L494-K497 WeakPolarHBondContact O-CB 3.32Å; L494-K497 PolarHBondContact O-N 3.02Å; L494-M498 HydrophobicContact CD1-CE 3.84Å; L494-M498 HydrophobicContact CD2-CE 4.12Å; L494-M498 HydrophobicContact CG-CE 3.79Å; L494-M498 WeakPolarHBondContact O-CG 3.41Å; L494-M498 PolarHBondContact O-N 2.96Å; L494-I507 HydrophobicContact CD1-CD1 3.71Å; L494-I507 HydrophobicContact CD1-CG2 4.49Å; L494-T512 HydrophobicContact CD1-CG2 4.31Å; L494-T512 HydrophobicContact CD2-CG2 4.42Å; L494-H515 HydrophobicContact CD1-CB 3.97Å; L494-H515 HydrophobicContact CD2-CB 4.2Å; L494-F517 HydrophobicContact CD2-CB 4.02Å; L494-F517 HydrophobicContact CD2-CD1 3.84Å; L494-F517 HydrophobicContact CD2-CG 4.33Å; L494-V518 HydrophobicContact CD2-CG2 4.02Å
495	L	98.9	Very high	98	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.8	-44	178.5	-179.4	60.7	0	0	0	111.5	G379 I382 A383 M467 Y491 I492 K497 M498 L499	G379-L495 WeakPolarHBondContact O-CD1 3.31Å; I382-L495 HydrophobicContact CD1-CD1 4.3Å; I382-L495 HydrophobicContact CG1-CD1 4.05Å; A383-L495 HydrophobicContact CB-CD1 4.13Å; A383-L495 HydrophobicContact CB-CD2 4.19Å; M467-L495 HydrophobicContact CE-CD2 3.57Å; M467-L495 HydrophobicContact SD-CD2 3.86Å; Y491-L495 HydrophobicContact CE1-CD2 4.37Å; Y491-L495 WeakPolarHBondContact O-CB 3.19Å; Y491-L495 PolarHBondContact O-N 3.42Å; I492-L495 HydrophobicContact CD1-CD2 3.99Å; I492-L495 PolarHBondContact O-N 3.48Å; L495-K497 VanDerWaalsContact C-N 3.28Å; L495-K497 PolarHBondContact O-N 3.31Å; L495-M498 PolarHBondContact O-N 3.34Å; L495-L499 HydrophobicContact CD1-CD1 3.67Å; L495-L499 HydrophobicContact CD1-CG 3.97Å; L495-L499 HydrophobicContact CG-CD1 4.01Å; L495-L499 WeakPolarHBondContact O-CB 3.19Å; L495-L499 PolarHBondContact O-N 2.81Å
496	K	98.8	Very high	98.2	Very high	76 Å²	76	37.4 Å²	37.4	33%	0.33	18%	0.177	S	C	.	.	H	α-helix	trans	-61.6	-36.2	174.7	-74.9	167.1	59.4	164.7	0	112.1	L464 D465 I492 D493 L494 L499 T500	L464-K496 HydrophobicContact CB-CD 4.12Å; L464-K496 HydrophobicContact CB-CG 3.69Å; L464-K496 HydrophobicContact CD1-CG 3.76Å; L464-K496 HydrophobicContact CG-CG 4.38Å; D465-K496 WeakPolarHBondContact OD1-CD 3.38Å; D465-K496 IonicContact OD1-NZ 3.47Å; D465-K496 PolarHBondContact OD1-NZ 3.06Å; D465-K496 IonicContact OD2-NZ 3.7Å; D465-K496 PolarHBondContact OD2-NZ 2.68Å; I492-K496 HydrophobicContact CG2-CD 3.89Å; I492-K496 HydrophobicContact CG2-CG 4.47Å; I492-K496 WeakPolarHBondContact O-CB 3.23Å; I492-K496 WeakPolarHBondContact O-CG 3.42Å; I492-K496 PolarHBondContact O-N 3.34Å; D493-K496 PolarHBondContact O-N 2.89Å; L494-K496 PolarHBondContact O-N 3.49Å; K496-L499 CarbonylContact O-C 3.46Å; K496-T500 PolarHBondContact O-N 2.91Å; K496-T500 VanDerWaalsContact O-N 3.14Å; K496-T500 PolarHBondContact O-OG1 2.88Å
497	K	98.9	Very high	98.4	Very high	84 Å²	84	38.1 Å²	38.1	37%	0.365	18%	0.181	S	C	.	.	H	α-helix	trans	-71.8	-28.6	175.5	-73.2	166.6	176.9	165.9	0	113.4	D493 L494 L495 T500 I507 H515	D493-K497 WeakPolarHBondContact O-CB 3.44Å; D493-K497 WeakPolarHBondContact O-CD 3.24Å; D493-K497 VanDerWaalsContact O-CG 3.25Å; D493-K497 WeakPolarHBondContact O-CG 3.32Å; D493-K497 PolarHBondContact O-N 2.73Å; D493-K497 VanDerWaalsContact O-N 3.12Å; D493-K497 WeakPolarHBondContact OD1-CE 3.31Å; D493-K497 IonicContact OD1-NZ 3.95Å; D493-K497 PolarHBondContact OD1-NZ 2.9Å; D493-K497 WeakPolarHBondContact OD2-CE 3.28Å; D493-K497 IonicContact OD2-NZ 2.73Å; D493-K497 PolarHBondContact OD2-NZ 3.4Å; L494-K497 CarbonylContact O-C 3.3Å; L494-K497 WeakPolarHBondContact O-CB 3.32Å; L494-K497 PolarHBondContact O-N 3.02Å; L495-K497 VanDerWaalsContact C-N 3.28Å; L495-K497 PolarHBondContact O-N 3.31Å; K497-T500 PolarHBondContact O-OG1 3.46Å; K497-I507 HydrophobicContact CB-CB 4.02Å; K497-I507 HydrophobicContact CB-CD1 4.26Å; K497-I507 HydrophobicContact CB-CG2 4.07Å; K497-I507 WeakPolarHBondContact O-CG2 3.38Å; K497-I507 PolarHBondContact O-N 3.47Å; K497-H515 WeakPolarHBondContact CD-NE2 3.32Å; K497-H515 PolarHBondContact NZ-NE2 3.28Å
498	M	98.9	Very high	98.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-78.6	-43.9	171.1	-71.2	176.5	179.5	0	0	112.6	L296 M375 L378 I382 L494 L495 T500 R506 I507 T512	L296-M498 HydrophobicContact CD1-CE 3.58Å; L296-M498 HydrophobicContact CD2-CE 4.25Å; M375-M498 HydrophobicContact CE-CE 4.11Å; M375-M498 HydrophobicContact CE-CG 4.16Å; L378-M498 HydrophobicContact CD2-CE 4.47Å; L378-M498 HydrophobicContact CG-SD 4.47Å; I382-M498 HydrophobicContact CD1-CE 4.22Å; I382-M498 HydrophobicContact CD1-SD 3.54Å; I382-M498 VanDerWaalsContact CD1-SD 3.54Å; I382-M498 HydrophobicContact CG1-SD 4.48Å; L494-M498 HydrophobicContact CD1-CE 3.84Å; L494-M498 HydrophobicContact CD2-CE 4.12Å; L494-M498 HydrophobicContact CG-CE 3.79Å; L494-M498 WeakPolarHBondContact O-CG 3.41Å; L494-M498 PolarHBondContact O-N 2.96Å; L495-M498 PolarHBondContact O-N 3.34Å; M498-T500 PolarHBondContact O-N 3.3Å; M498-R506 WeakPolarHBondContact O-CD 3.44Å; M498-R506 WeakPolarHBondContact O-CG 3.44Å; M498-I507 HydrophobicContact CB-CG2 4.38Å; M498-I507 HydrophobicContact CG-CG2 3.65Å; M498-T512 HydrophobicContact CE-CG2 3.4Å; M498-T512 VanDerWaalsContact CE-CG2 3.4Å
499	L	98.9	Very high	98.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.196	C	C	.	.	S	Bend	trans	-85.6	25.2	177.5	-60	-179.5	0	0	0	112.2	W376 L391 Y392 Q408 L464 L495 K496 I501	W376-L499 HydrophobicContact CD2-CD2 3.85Å; W376-L499 HydrophobicContact CE3-CB 4.4Å; W376-L499 HydrophobicContact CE3-CD2 4.09Å; W376-L499 HydrophobicContact CG-CD2 4.33Å; W376-L499 HydrophobicContact CH2-CB 4.35Å; W376-L499 HydrophobicContact CH2-CD2 4.3Å; W376-L499 HydrophobicContact CZ2-CD2 4.09Å; W376-L499 VanDerWaalsContact CZ3-C 3.5Å; W376-L499 HydrophobicContact CZ3-CB 4.09Å; W376-L499 HydrophobicContact CZ3-CD2 4.32Å; W376-L499 WeakPolarHBondContact CZ3-O 3.48Å; L391-L499 HydrophobicContact CD2-CD1 3.48Å; L391-L499 VanDerWaalsContact CD2-CD1 3.48Å; Y392-L499 HydrophobicContact CE2-CD1 4.39Å; Q408-L499 PolarHBondContact NE2-O 3.34Å; L464-L499 HydrophobicContact CD1-CB 4.11Å; L464-L499 HydrophobicContact CD1-CD1 4.06Å; L464-L499 HydrophobicContact CD2-CD1 4.17Å; L495-L499 HydrophobicContact CD1-CD1 3.67Å; L495-L499 HydrophobicContact CD1-CG 3.97Å; L495-L499 HydrophobicContact CG-CD1 4.01Å; L495-L499 WeakPolarHBondContact O-CB 3.19Å; L495-L499 PolarHBondContact O-N 2.81Å; K496-L499 CarbonylContact O-C 3.46Å; L499-I501 PolarHBondContact O-N 2.85Å
500	T	98.8	Very high	98.6	Very high	36 Å²	36	38.2 Å²	38.2	22%	0.221	19%	0.194	C	C	.	.			trans	-68.5	120	171.9	-62.4	0	0	0	0	108.6	K496 K497 M498 D502 K505 R506	K496-T500 PolarHBondContact O-N 2.91Å; K496-T500 VanDerWaalsContact O-N 3.14Å; K496-T500 PolarHBondContact O-OG1 2.88Å; K497-T500 PolarHBondContact O-OG1 3.46Å; M498-T500 PolarHBondContact O-N 3.3Å; T500-D502 VanDerWaalsContact C-N 3.32Å; T500-D502 PolarHBondContact O-N 3.36Å; T500-K505 HydrophobicContact CG2-CB 3.81Å; T500-R506 PolarHBondContact O-NE 3.43Å; T500-R506 PolarHBondContact O-NH2 3.11Å
501	I	98.6	Very high	98.6	Very high	23 Å²	23	43.7 Å²	43.7	12%	0.118	22%	0.218	C	C	.	.	S	Bend	trans	-58.9	-44.8	-173.3	-65	174.7	0	0	0	110.9	P361 W376 I404 Q408 P411 L415 L499 A503 R506	P361-I501 HydrophobicContact CB-CG2 3.95Å; P361-I501 HydrophobicContact CG-CB 4.47Å; P361-I501 HydrophobicContact CG-CG1 4.5Å; P361-I501 HydrophobicContact CG-CG2 4.04Å; W376-I501 HydrophobicContact CZ3-CG1 4.34Å; I404-I501 HydrophobicContact CG2-CD1 4.18Å; I404-I501 HydrophobicContact CG2-CG1 4.3Å; Q408-I501 HydrophobicContact CB-CD1 4.05Å; P411-I501 HydrophobicContact CB-CG2 3.83Å; P411-I501 HydrophobicContact CG-CG2 4.15Å; L415-I501 HydrophobicContact CD1-CG2 4.08Å; L499-I501 PolarHBondContact O-N 2.85Å; I501-A503 PolarHBondContact O-N 3.2Å; I501-R506 PolarHBondContact O-NH2 2.6Å
502	D	98.5	Very high	98.6	Very high	13 Å²	13	43.7 Å²	43.7	7%	0.07	22%	0.218	C	C	.	.	S	Bend	trans	-70.5	117.9	171.3	178.2	10.8	0	0	0	111.2	Y414 L415 T500 D504 K505 R506	Y414-D502 PolarHBondContact OH-OD2 3.08Å; L415-D502 HydrophobicContact CD1-CB 4.12Å; T500-D502 VanDerWaalsContact C-N 3.32Å; T500-D502 PolarHBondContact O-N 3.36Å; D502-D504 VanDerWaalsContact C-N 3.31Å; D502-D504 PolarHBondContact O-N 3.21Å; D502-D504 PolarHBondContact OD1-N 3.25Å; D502-K505 HydrophobicContact CB-CB 4.27Å; D502-K505 HydrophobicContact CB-CD 4.35Å; D502-K505 HydrophobicContact CB-CG 4.49Å; D502-K505 PolarHBondContact O-N 3.4Å; D502-K505 WeakPolarHBondContact OD2-CD 3.4Å; D502-K505 WeakPolarHBondContact OD2-CE 3.33Å; D502-K505 WeakPolarHBondContact OD2-CG 3.26Å; D502-K505 IonicContact OD2-NZ 3.8Å; D502-K505 PolarHBondContact OD2-NZ 2.99Å; D502-R506 PolarHBondContact O-N 3.3Å
503	A	98.3	Very high	98.6	Very high	22 Å²	22	44.6 Å²	44.6	18%	0.182	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-33.7	-179.7	0	0	0	0	0	113.2	E362 A372 I501 K505 R506	E362-A503 WeakPolarHBondContact OE1-CB 3.41Å; A372-A503 HydrophobicContact CB-CB 4.19Å; I501-A503 PolarHBondContact O-N 3.2Å; A503-K505 VanDerWaalsContact C-N 3.31Å; A503-K505 PolarHBondContact O-N 2.67Å; A503-R506 VanDerWaalsContact O-CB 3.31Å; A503-R506 WeakPolarHBondContact O-CB 3.3Å; A503-R506 PolarHBondContact O-N 2.8Å
504	D	97.8	Very high	98.6	Very high	153 Å²	153	47.7 Å²	47.7	82%	0.818	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-24.8	-177.9	-71	-26.2	0	0	0	112.3	D502	D502-D504 VanDerWaalsContact C-N 3.31Å; D502-D504 PolarHBondContact O-N 3.21Å; D502-D504 PolarHBondContact OD1-N 3.25Å
505	K	98.3	Very high	98.6	Very high	141 Å²	141	48.5 Å²	48.5	61%	0.613	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-10.8	174.1	-69	175.5	-172.4	74.7	0	113	Y414 T500 D502 A503	Y414-K505 PolarHBondContact OH-NZ 2.99Å; T500-K505 HydrophobicContact CG2-CB 3.81Å; D502-K505 HydrophobicContact CB-CB 4.27Å; D502-K505 HydrophobicContact CB-CD 4.35Å; D502-K505 HydrophobicContact CB-CG 4.49Å; D502-K505 PolarHBondContact O-N 3.4Å; D502-K505 WeakPolarHBondContact OD2-CD 3.4Å; D502-K505 WeakPolarHBondContact OD2-CE 3.33Å; D502-K505 WeakPolarHBondContact OD2-CG 3.26Å; D502-K505 IonicContact OD2-NZ 3.8Å; D502-K505 PolarHBondContact OD2-NZ 2.99Å; A503-K505 VanDerWaalsContact C-N 3.31Å; A503-K505 PolarHBondContact O-N 2.67Å
506	R	98.8	Very high	98.5	Very high	9 Å²	9	52.6 Å²	52.6	3%	0.034	26%	0.262	C	S	.	.	S	Bend	trans	-68.1	146.5	-176.7	-160.5	176.6	-64	150.6	7.1	112	E362 A372 M498 T500 I501 D502 A503	E362-R506 IonicContact OE1-CZ 2.73Å; E362-R506 IonicContact OE1-NH1 3.43Å; E362-R506 PolarHBondContact OE1-NH1 3.35Å; E362-R506 IonicContact OE1-NH2 3.31Å; E362-R506 PolarHBondContact OE1-NH2 2.98Å; E362-R506 IonicContact OE2-CZ 3.5Å; E362-R506 IonicContact OE2-NH1 2.66Å; E362-R506 PolarHBondContact OE2-NH1 2.71Å; E362-R506 IonicContact OE2-NH2 2.67Å; E362-R506 PolarHBondContact OE2-NH2 3.37Å; A372-R506 WeakPolarHBondContact O-CD 3.1Å; A372-R506 PolarHBondContact O-NH1 2.85Å; M498-R506 WeakPolarHBondContact O-CD 3.44Å; M498-R506 WeakPolarHBondContact O-CG 3.44Å; T500-R506 PolarHBondContact O-NE 3.43Å; T500-R506 PolarHBondContact O-NH2 3.11Å; I501-R506 PolarHBondContact O-NH2 2.6Å; D502-R506 PolarHBondContact O-N 3.3Å; A503-R506 VanDerWaalsContact O-CB 3.31Å; A503-R506 WeakPolarHBondContact O-CB 3.3Å; A503-R506 PolarHBondContact O-N 2.8Å
507	I	98.8	Very high	98.5	Very high	17 Å²	17	49 Å²	49	9%	0.087	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-68.7	134.3	179.9	-162.3	170.1	0	0	0	111.7	M375 L494 K497 M498 K511 T512	M375-I507 HydrophobicContact CE-CG2 4.02Å; M375-I507 WeakPolarHBondContact CG-O 3.41Å; L494-I507 HydrophobicContact CD1-CD1 3.71Å; L494-I507 HydrophobicContact CD1-CG2 4.49Å; K497-I507 HydrophobicContact CB-CB 4.02Å; K497-I507 HydrophobicContact CB-CD1 4.26Å; K497-I507 HydrophobicContact CB-CG2 4.07Å; K497-I507 WeakPolarHBondContact O-CG2 3.38Å; K497-I507 PolarHBondContact O-N 3.47Å; M498-I507 HydrophobicContact CB-CG2 4.38Å; M498-I507 HydrophobicContact CG-CG2 3.65Å; I507-K511 HydrophobicContact CD1-CB 3.99Å; I507-K511 HydrophobicContact CG1-CB 3.45Å; I507-K511 VanDerWaalsContact CG1-CB 3.45Å; I507-K511 HydrophobicContact CG1-CD 4.5Å; I507-T512 WeakPolarHBondContact CG2-OG1 3.36Å
508	T	98.8	Very high	98.5	Very high	50 Å²	50	45.5 Å²	45.5	31%	0.307	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-84.8	156.1	176.1	60.2	0	0	0	0	111	L510 K511 T512	T508-L510 VanDerWaalsContact C-N 3.28Å; T508-L510 PolarHBondContact O-N 3.41Å; T508-L510 VanDerWaalsContact O-N 3.15Å; T508-K511 WeakPolarHBondContact O-CA 3.42Å; T508-K511 WeakPolarHBondContact O-CB 3.47Å; T508-K511 PolarHBondContact O-N 2.66Å; T508-K511 WeakPolarHBondContact OG1-CG 3.33Å; T508-T512 PolarHBondContact O-N 3.23Å
509	P	98.7	Very high	98.4	Very high	7 Å²	7	48.4 Å²	48.4	5%	0.045	25%	0.25	C	S	.	.	H	α-helix	trans	-53.6	-40.6	-177	-23.6	28	0	0	0	114.2	A300 L303 M304 M375 T512 L513	A300-P509 WeakPolarHBondContact O-CB 3.45Å; L303-P509 HydrophobicContact CB-CB 4.09Å; L303-P509 HydrophobicContact CB-CG 3.74Å; M304-P509 HydrophobicContact CB-CB 3.8Å; M304-P509 VanDerWaalsContact N-CB 3.33Å; M375-P509 HydrophobicContact CG-CG 4.14Å; M375-P509 HydrophobicContact SD-CB 4.07Å; M375-P509 HydrophobicContact SD-CG 3.58Å; M375-P509 VanDerWaalsContact SD-CG 3.58Å; P509-T512 WeakPolarHBondContact O-CB 3.18Å; P509-T512 PolarHBondContact O-N 2.78Å; P509-L513 WeakPolarHBondContact O-CG 3.29Å; P509-L513 PolarHBondContact O-N 3.13Å
510	L	98.2	Very high	98.3	Very high	96 Å²	96	48.6 Å²	48.6	50%	0.503	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-39	176.4	179.3	61.3	0	0	0	112.6	M304 T508 T512 L513 N514	M304-L510 HydrophobicContact SD-CB 4.48Å; M304-L510 HydrophobicContact SD-CD1 3.98Å; T508-L510 VanDerWaalsContact C-N 3.28Å; T508-L510 PolarHBondContact O-N 3.41Å; T508-L510 VanDerWaalsContact O-N 3.15Å; L510-T512 VanDerWaalsContact C-N 3.32Å; L510-L513 PolarHBondContact O-N 3.33Å; L510-N514 PolarHBondContact O-N 3.06Å; L510-N514 PolarHBondContact O-ND2 3.02Å
511	K	98.6	Very high	98.2	Very high	136 Å²	136	49.8 Å²	49.8	59%	0.591	26%	0.258	S	S	*	.	H	α-helix	trans	-68.6	-32.9	174.5	-71.8	177.5	179.9	178	0	111.4	I507 T508 N514 H515	I507-K511 HydrophobicContact CD1-CB 3.99Å; I507-K511 HydrophobicContact CG1-CB 3.45Å; I507-K511 VanDerWaalsContact CG1-CB 3.45Å; I507-K511 HydrophobicContact CG1-CD 4.5Å; T508-K511 WeakPolarHBondContact O-CA 3.42Å; T508-K511 WeakPolarHBondContact O-CB 3.47Å; T508-K511 PolarHBondContact O-N 2.66Å; T508-K511 WeakPolarHBondContact OG1-CG 3.33Å; K511-N514 PolarHBondContact O-N 3.2Å; K511-H515 PolarHBondContact O-N 2.9Å
512	T	98.7	Very high	98	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-45.3	172.2	-71	0	0	0	0	112.2	L296 A300 M375 L494 M498 I507 T508 P509 L510 N514 H515 V518	L296-T512 HydrophobicContact CD1-CG2 4.21Å; A300-T512 HydrophobicContact CB-CG2 3.83Å; M375-T512 HydrophobicContact CE-CG2 4.47Å; M375-T512 WeakPolarHBondContact CE-OG1 3.08Å; L494-T512 HydrophobicContact CD1-CG2 4.31Å; L494-T512 HydrophobicContact CD2-CG2 4.42Å; M498-T512 HydrophobicContact CE-CG2 3.4Å; M498-T512 VanDerWaalsContact CE-CG2 3.4Å; I507-T512 WeakPolarHBondContact CG2-OG1 3.36Å; T508-T512 PolarHBondContact O-N 3.23Å; P509-T512 WeakPolarHBondContact O-CB 3.18Å; P509-T512 PolarHBondContact O-N 2.78Å; L510-T512 VanDerWaalsContact C-N 3.32Å; T512-N514 PolarHBondContact O-N 3.08Å; T512-H515 WeakPolarHBondContact O-CB 3.35Å; T512-H515 PolarHBondContact O-N 3.28Å; T512-V518 WeakPolarHBondContact O-CG2 3.3Å
513	L	98.4	Very high	97.9	Very high	24 Å²	24	48.6 Å²	48.6	13%	0.126	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-31.2	177.6	-70.1	170.1	0	0	0	112.6	Q297 A300 M304 P509 L510 H515 T519	Q297-L513 HydrophobicContact CG-CD2 3.98Å; Q297-L513 WeakPolarHBondContact O-CD2 3.25Å; A300-L513 HydrophobicContact CB-CD2 3.87Å; A300-L513 HydrophobicContact CB-CG 4.1Å; M304-L513 HydrophobicContact CB-CD1 4.32Å; M304-L513 HydrophobicContact CE-CD1 4.13Å; M304-L513 HydrophobicContact SD-CD1 3.66Å; P509-L513 WeakPolarHBondContact O-CG 3.29Å; P509-L513 PolarHBondContact O-N 3.13Å; L510-L513 PolarHBondContact O-N 3.33Å; L513-H515 VanDerWaalsContact C-N 3.34Å; L513-T519 WeakPolarHBondContact O-CG2 3.41Å
514	N	98.3	Very high	97.7	Very high	115 Å²	115	52.7 Å²	52.7	62%	0.615	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	4.4	176.1	-64.6	-16.5	0	0	0	113.8	L510 K511 T512	L510-N514 PolarHBondContact O-N 3.06Å; L510-N514 PolarHBondContact O-ND2 3.02Å; K511-N514 PolarHBondContact O-N 3.2Å; T512-N514 PolarHBondContact O-N 3.08Å
515	H	98.7	Very high	97.3	Very high	17 Å²	17	51.6 Å²	51.6	8%	0.079	26%	0.264	C	S	.	.	S	Bend	trans	-78.7	145.9	-177.3	-167.2	-81.3	0	0	0	111.9	E490 D493 L494 K497 K511 T512 L513 F517 V518 T519	E490-H515 VanDerWaalsContact CA-CE1 3.41Å; E490-H515 WeakPolarHBondContact CA-CE1 3.36Å; E490-H515 PolarHBondContact O-CE1 2.96Å; E490-H515 IonicContact OE2-CE1 3.07Å; D493-H515 IonicContact OD1-NE2 2.69Å; D493-H515 IonicContact OD2-CD2 2.62Å; D493-H515 IonicContact OD2-CE1 3.61Å; D493-H515 PolarHBondContact OD2-CE1 3.28Å; D493-H515 CovalentContact OD2-NE2 1.8Å; D493-H515 IonicContact OD2-NE2 2.69Å; D493-H515 PolarHBondContact OD2-NE2 3.36Å; L494-H515 HydrophobicContact CD1-CB 3.97Å; L494-H515 HydrophobicContact CD2-CB 4.2Å; K497-H515 WeakPolarHBondContact CD-NE2 3.32Å; K497-H515 PolarHBondContact NZ-NE2 3.28Å; K511-H515 PolarHBondContact O-N 2.9Å; T512-H515 WeakPolarHBondContact O-CB 3.35Å; T512-H515 PolarHBondContact O-N 3.28Å; L513-H515 VanDerWaalsContact C-N 3.34Å; H515-F517 PolarHBondContact ND1-N 2.66Å; H515-F517 VanDerWaalsContact ND1-N 3.19Å; H515-F517 PolarHBondContact O-N 3.12Å; H515-F517 VanDerWaalsContact O-N 3.11Å; H515-V518 PolarHBondContact O-N 3.17Å; H515-T519 PolarHBondContact O-N 3.32Å; H515-T519 PolarHBondContact O-OG1 2.67Å
516	Q	97.8	Very high	97.1	Very high	86 Å²	86	47 Å²	47	40%	0.402	24%	0.244	S	C	.	.	H	α-helix	trans	-53.8	-34.5	-176.3	-59.8	-152.2	97.4	0	0	113.7	E490 V518 T519 M520 T521 H522	E490-Q516 HydrophobicContact CB-CB 4.4Å; E490-Q516 HydrophobicContact CG-CB 4.09Å; E490-Q516 WeakPolarHBondContact OE2-CB 3.47Å; E490-Q516 PolarHBondContact OE2-NE2 2.93Å; Q516-V518 VanDerWaalsContact C-N 3.33Å; Q516-V518 PolarHBondContact O-N 3.17Å; Q516-T519 WeakPolarHBondContact CA-OG1 3.5Å; Q516-M520 VanDerWaalsContact O-CA 3.3Å; Q516-M520 WeakPolarHBondContact O-CA 3.36Å; Q516-M520 PolarHBondContact O-N 3.28Å; Q516-T521 PolarHBondContact OE1-OG1 3.44Å; Q516-T521 VanDerWaalsContact OE1-OG1 3.07Å; Q516-H522 PolarHBondContact O-CE1 2.91Å; Q516-H522 PolarHBondContact O-ND1 3.44Å
517	F	98.4	Very high	96.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-39.7	175.3	177	-105.5	0	0	0	112.3	L289 R293 L296 D487 E490 Y491 L494 H515	L289-F517 HydrophobicContact CB-CE2 4.16Å; L289-F517 HydrophobicContact CB-CZ 4.33Å; L289-F517 HydrophobicContact CD1-CE2 4.28Å; L289-F517 HydrophobicContact CD2-CE2 4.14Å; L289-F517 HydrophobicContact CD2-CZ 4.12Å; L289-F517 HydrophobicContact CG-CE2 4.44Å; R293-F517 HydrophobicContact CB-CE1 3.94Å; R293-F517 HydrophobicContact CB-CZ 3.89Å; R293-F517 WeakPolarHBondContact CD-O 3.44Å; R293-F517 HydrophobicContact CG-CD1 4.38Å; R293-F517 HydrophobicContact CG-CE1 3.97Å; R293-F517 HydrophobicContact CG-CZ 4.25Å; R293-F517 PolarHBondContact NE-O 3.3Å; L296-F517 HydrophobicContact CD2-CD1 3.88Å; L296-F517 HydrophobicContact CD2-CE1 3.79Å; D487-F517 VanDerWaalsContact OD1-CD2 3.31Å; D487-F517 WeakPolarHBondContact OD1-CD2 3.5Å; D487-F517 WeakPolarHBondContact OD1-CE2 3.39Å; E490-F517 HydrophobicContact CB-CB 4.01Å; Y491-F517 HydrophobicContact CD2-CE1 4.08Å; Y491-F517 HydrophobicContact CD2-CE2 4.08Å; Y491-F517 AromaticContact CD2-CZ 3.84Å; Y491-F517 HydrophobicContact CD2-CZ 3.84Å; Y491-F517 HydrophobicContact CG-CE2 4.29Å; Y491-F517 HydrophobicContact CG-CZ 4.48Å; L494-F517 HydrophobicContact CD2-CB 4.02Å; L494-F517 HydrophobicContact CD2-CD1 3.84Å; L494-F517 HydrophobicContact CD2-CG 4.33Å; H515-F517 PolarHBondContact ND1-N 2.66Å; H515-F517 VanDerWaalsContact ND1-N 3.19Å; H515-F517 PolarHBondContact O-N 3.12Å; H515-F517 VanDerWaalsContact O-N 3.11Å
518	V	98	Very high	95.8	Very high	10 Å²	10	57.1 Å²	57.1	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-84.5	-40.7	-176.8	-179	0	0	0	0	111.5	L296 Q297 L494 T512 H515 Q516 M520	L296-V518 HydrophobicContact CD2-CG2 4.08Å; L296-V518 HydrophobicContact CG-CG2 4.45Å; Q297-V518 HydrophobicContact CB-CG1 4.01Å; Q297-V518 HydrophobicContact CG-CG1 3.87Å; L494-V518 HydrophobicContact CD2-CG2 4.02Å; T512-V518 WeakPolarHBondContact O-CG2 3.3Å; H515-V518 PolarHBondContact O-N 3.17Å; Q516-V518 VanDerWaalsContact C-N 3.33Å; Q516-V518 PolarHBondContact O-N 3.17Å; V518-M520 VanDerWaalsContact C-N 3.29Å
519	T	97.1	Very high	95.5	Very high	62 Å²	62	54.8 Å²	54.8	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-77.5	-14.2	177.7	61.2	0	0	0	0	113.5	L513 H515 Q516 T521	L513-T519 WeakPolarHBondContact O-CG2 3.41Å; H515-T519 PolarHBondContact O-N 3.32Å; H515-T519 PolarHBondContact O-OG1 2.67Å; Q516-T519 WeakPolarHBondContact CA-OG1 3.5Å; T519-T521 PolarHBondContact O-N 2.87Å
520	M	96.7	Very high	95.1	Very high	4 Å²	4	59 Å²	59	2%	0.02	31%	0.306	C	S	.	.			trans	60.4	20.3	-179	-60.1	176.9	47.1	0	0	115.6	Q516 V518 H522 L523 C535 F536 M539	Q516-M520 VanDerWaalsContact O-CA 3.3Å; Q516-M520 WeakPolarHBondContact O-CA 3.36Å; Q516-M520 PolarHBondContact O-N 3.28Å; V518-M520 VanDerWaalsContact C-N 3.29Å; M520-H522 VanDerWaalsContact C-N 3.29Å; M520-H522 PolarHBondContact O-N 3.14Å; M520-L523 HydrophobicContact CB-CD1 4.27Å; M520-L523 HydrophobicContact CE-CD1 3.77Å; M520-L523 HydrophobicContact CG-CD1 4.26Å; M520-L523 WeakPolarHBondContact O-CB 3.49Å; M520-L523 PolarHBondContact O-N 3.37Å; M520-C535 HydrophobicContact CE-CB 3.34Å; M520-C535 HydrophobicContact SD-CB 4.12Å; M520-F536 HydrophobicContact CB-CE1 4.07Å; M520-F536 HydrophobicContact CB-CZ 4.11Å; M520-F536 HydrophobicContact CE-CB 4.2Å; M520-F536 HydrophobicContact CE-CD1 3.44Å; M520-F536 VanDerWaalsContact CE-CD1 3.44Å; M520-F536 HydrophobicContact CE-CD2 3.5Å; M520-F536 HydrophobicContact CE-CE1 3.53Å; M520-F536 HydrophobicContact CE-CE2 3.6Å; M520-F536 HydrophobicContact CE-CG 3.42Å; M520-F536 VanDerWaalsContact CE-CG 3.42Å; M520-F536 HydrophobicContact CE-CZ 3.61Å; M520-F536 HydrophobicContact SD-CD1 3.95Å; M520-F536 HydrophobicContact SD-CE1 4.07Å; M520-F536 HydrophobicContact SD-CG 4.39Å; M520-M539 HydrophobicContact SD-CB 4.37Å; M520-M539 HydrophobicContact SD-CG 3.64Å
521	T	96.4	Very high	94.7	Very high	61 Å²	61	55.3 Å²	55.3	37%	0.374	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-54.9	-43.7	179.9	48.1	0	0	0	0	112.7	Q516 T519 L523 L524	Q516-T521 PolarHBondContact OE1-OG1 3.44Å; Q516-T521 VanDerWaalsContact OE1-OG1 3.07Å; T519-T521 PolarHBondContact O-N 2.87Å; T521-L523 PolarHBondContact O-N 3.24Å; T521-L523 VanDerWaalsContact O-N 3.08Å; T521-L524 WeakPolarHBondContact O-CB 3.47Å; T521-L524 WeakPolarHBondContact O-CG 3.38Å; T521-L524 PolarHBondContact O-N 3.12Å; T521-L524 VanDerWaalsContact O-N 3.12Å
522	H	95.7	Very high	94.5	Very high	11 Å²	11	49.1 Å²	49.1	5%	0.051	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-64.5	-6.2	177.9	71.8	-77.1	0	0	0	115.4	D487 E490 Q516 M520	D487-H522 WeakPolarHBondContact CA-NE2 3.25Å; D487-H522 IonicContact OD1-NE2 3.41Å; E490-H522 HydrophobicContact CG-CB 3.8Å; E490-H522 VanDerWaalsContact CG-CG 3.45Å; Q516-H522 PolarHBondContact O-CE1 2.91Å; Q516-H522 PolarHBondContact O-ND1 3.44Å; M520-H522 VanDerWaalsContact C-N 3.29Å; M520-H522 PolarHBondContact O-N 3.14Å
523	L	95.8	Very high	94.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-101.7	-9.6	176.8	-62.9	178.9	0	0	0	112.9	A483 D487 M520 T521 D525 F526 V532 C535	A483-L523 HydrophobicContact CB-CD2 4.46Å; D487-L523 HydrophobicContact CB-CD2 4.25Å; M520-L523 HydrophobicContact CB-CD1 4.27Å; M520-L523 HydrophobicContact CE-CD1 3.77Å; M520-L523 HydrophobicContact CG-CD1 4.26Å; M520-L523 WeakPolarHBondContact O-CB 3.49Å; M520-L523 PolarHBondContact O-N 3.37Å; T521-L523 PolarHBondContact O-N 3.24Å; T521-L523 VanDerWaalsContact O-N 3.08Å; L523-D525 PolarHBondContact O-N 3.13Å; L523-F526 PolarHBondContact O-N 3.42Å; L523-F526 VanDerWaalsContact O-N 3.17Å; L523-V532 HydrophobicContact CB-CG1 4.04Å; L523-V532 HydrophobicContact CB-CG2 3.82Å; L523-V532 HydrophobicContact CD1-CG2 4.49Å; L523-V532 HydrophobicContact CD2-CG2 4.05Å; L523-V532 HydrophobicContact CG-CG2 4.31Å; L523-C535 HydrophobicContact CD1-CB 4.17Å
524	L	93.2	Very high	94	Very high	108 Å²	108	54 Å²	54	57%	0.565	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.4	177.6	-61.3	174.8	0	0	0	112.2	T521 F526 P527 F536	T521-L524 WeakPolarHBondContact O-CB 3.47Å; T521-L524 WeakPolarHBondContact O-CG 3.38Å; T521-L524 PolarHBondContact O-N 3.12Å; T521-L524 VanDerWaalsContact O-N 3.12Å; L524-F526 PolarHBondContact O-N 3.05Å; L524-P527 WeakPolarHBondContact O-CD 3.28Å; L524-F536 HydrophobicContact CD2-CE2 4.41Å; L524-F536 HydrophobicContact CD2-CZ 3.85Å
525	D	91.1	Very high	93.8	Very high	130 Å²	130	48.5 Å²	48.5	70%	0.695	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.1	175.9	-59	-32	0	0	0	113.5	L523 P527	L523-D525 PolarHBondContact O-N 3.13Å; D525-P527 WeakPolarHBondContact O-CD 3.46Å
526	F	92.4	Very high	93.6	Very high	45 Å²	45	51.1 Å²	51.1	20%	0.197	27%	0.265	C	S	.	.			trans	-121.1	52.3	-176.9	-50.3	-81.9	0	0	0	112.6	L482 A483 A486 L523 L524 H528 S529 V532	L482-F526 HydrophobicContact CB-CD1 4.26Å; L482-F526 HydrophobicContact CB-CE1 3.68Å; L482-F526 HydrophobicContact CB-CZ 4.32Å; A483-F526 HydrophobicContact CB-CB 4.07Å; A483-F526 HydrophobicContact CB-CD2 4.12Å; A483-F526 HydrophobicContact CB-CG 3.99Å; A486-F526 HydrophobicContact CB-CE2 3.86Å; A486-F526 HydrophobicContact CB-CZ 4.34Å; L523-F526 PolarHBondContact O-N 3.42Å; L523-F526 VanDerWaalsContact O-N 3.17Å; L524-F526 PolarHBondContact O-N 3.05Å; F526-H528 PolarHBondContact O-N 2.94Å; F526-S529 VanDerWaalsContact O-CB 3.23Å; F526-S529 WeakPolarHBondContact O-CB 3.35Å; F526-S529 PolarHBondContact O-N 3.33Å; F526-V532 HydrophobicContact CB-CG2 4.06Å
527	P	84.8	Confident	93.5	Very high	85 Å²	85	53.6 Å²	53.6	55%	0.552	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.6	-166.3	27.6	-36.8	0	0	0	114.6	L524 D525	L524-P527 WeakPolarHBondContact O-CD 3.28Å; D525-P527 WeakPolarHBondContact O-CD 3.46Å
528	H	86.6	Confident	93.3	Very high	153 Å²	153	55 Å²	55	71%	0.708	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-11.5	178.5	-57.8	-50.1	0	0	0	113.9	F526 K533	F526-H528 PolarHBondContact O-N 2.94Å; H528-K533 VanDerWaalsContact O-CE 3.3Å; H528-K533 WeakPolarHBondContact O-CE 3.44Å; H528-K533 PolarHBondContact O-NZ 3.37Å
529	S	92.1	Very high	93.1	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.286	C	S	.	.			trans	-61.4	136.9	-179.8	162.3	0	0	0	0	112.3	D480 F526 H531 V532 K533	D480-S529 VanDerWaalsContact OD1-CA 3.31Å; D480-S529 WeakPolarHBondContact OD1-CA 3.3Å; D480-S529 VanDerWaalsContact OD1-CB 3.26Å; D480-S529 WeakPolarHBondContact OD1-CB 3.3Å; D480-S529 PolarHBondContact OD1-OG 2.89Å; F526-S529 VanDerWaalsContact O-CB 3.23Å; F526-S529 WeakPolarHBondContact O-CB 3.35Å; F526-S529 PolarHBondContact O-N 3.33Å; S529-H531 WeakPolarHBondContact OG-CB 3.39Å; S529-H531 PolarHBondContact OG-N 3.31Å; S529-V532 WeakPolarHBondContact OG-CG2 3.36Å; S529-V532 PolarHBondContact OG-N 3.14Å; S529-K533 VanDerWaalsContact O-CE 3.22Å; S529-K533 WeakPolarHBondContact O-CE 3.45Å; S529-K533 VanDerWaalsContact O-CG 3.3Å; S529-K533 WeakPolarHBondContact O-CG 3.27Å; S529-K533 PolarHBondContact O-N 2.75Å
530	N	90.9	Very high	92.9	Very high	95 Å²	95	57 Å²	57	51%	0.508	29%	0.289	S	S	.	.	H	α-helix	trans	-78.6	-31.4	173.8	-53.5	-60.6	0	0	0	111.5	D480 K533 S534	D480-N530 PolarHBondContact OD1-N 3.36Å; D480-N530 PolarHBondContact OD2-N 3.23Å; D480-N530 PolarHBondContact OD2-ND2 2.81Å; N530-K533 PolarHBondContact OD1-NZ 3.4Å; N530-S534 VanDerWaalsContact O-CB 3.3Å; N530-S534 WeakPolarHBondContact O-CB 3.32Å; N530-S534 PolarHBondContact O-N 2.98Å
531	H	89.9	Confident	92.7	Very high	20 Å²	20	58.8 Å²	58.8	9%	0.093	30%	0.298	C	S	.	.	H	α-helix	trans	-57.1	-48.5	167.8	179.9	62.6	0	0	0	111.3	D480 E484 D487 S529 S534 C535	D480-H531 PolarHBondContact OD1-N 3.22Å; E484-H531 IonicContact OE2-CE1 2.67Å; E484-H531 PolarHBondContact OE2-CE1 3.18Å; E484-H531 IonicContact OE2-ND1 3.99Å; E484-H531 IonicContact OE2-NE2 2.78Å; E484-H531 PolarHBondContact OE2-NE2 3.13Å; D487-H531 IonicContact OD2-CE1 3.49Å; D487-H531 IonicContact OD2-NE2 3.6Å; D487-H531 PolarHBondContact OD2-NE2 2.93Å; S529-H531 WeakPolarHBondContact OG-CB 3.39Å; S529-H531 PolarHBondContact OG-N 3.31Å; H531-S534 CarbonylContact O-C 3.46Å; H531-S534 PolarHBondContact O-N 2.96Å; H531-C535 VanDerWaalsContact CE1-SG 3.56Å; H531-C535 PolarHBondContact O-N 3.3Å; H531-C535 PolarHBondContact O-SG 3.26Å
532	V	93.3	Very high	92.4	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.03	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-46.5	178.7	173.8	0	0	0	0	112.3	A483 L523 F526 S529 S534 C535 F536	A483-V532 HydrophobicContact CB-CG2 3.83Å; L523-V532 HydrophobicContact CB-CG1 4.04Å; L523-V532 HydrophobicContact CB-CG2 3.82Å; L523-V532 HydrophobicContact CD1-CG2 4.49Å; L523-V532 HydrophobicContact CD2-CG2 4.05Å; L523-V532 HydrophobicContact CG-CG2 4.31Å; F526-V532 HydrophobicContact CB-CG2 4.06Å; S529-V532 WeakPolarHBondContact OG-CG2 3.36Å; S529-V532 PolarHBondContact OG-N 3.14Å; V532-S534 VanDerWaalsContact C-N 3.29Å; V532-S534 PolarHBondContact O-N 3.09Å; V532-C535 WeakPolarHBondContact O-CB 3.48Å; V532-C535 PolarHBondContact O-N 2.91Å; V532-C535 VanDerWaalsContact O-N 3.14Å; V532-F536 HydrophobicContact CG1-CD2 3.74Å; V532-F536 HydrophobicContact CG1-CE2 3.56Å; V532-F536 WeakPolarHBondContact O-CD2 3.04Å; V532-F536 PolarHBondContact O-N 3.03Å
533	K	93.3	Very high	91.8	Very high	104 Å²	104	62.2 Å²	62.2	45%	0.452	31%	0.31	S	S	.	.	H	α-helix	trans	-55.7	-45.7	173.6	-66.6	163.7	-148.3	156.7	0	111.3	H528 S529 N530 C535 F536 Q537	H528-K533 VanDerWaalsContact O-CE 3.3Å; H528-K533 WeakPolarHBondContact O-CE 3.44Å; H528-K533 PolarHBondContact O-NZ 3.37Å; S529-K533 VanDerWaalsContact O-CE 3.22Å; S529-K533 WeakPolarHBondContact O-CE 3.45Å; S529-K533 VanDerWaalsContact O-CG 3.3Å; S529-K533 WeakPolarHBondContact O-CG 3.27Å; S529-K533 PolarHBondContact O-N 2.75Å; N530-K533 PolarHBondContact OD1-NZ 3.4Å; K533-C535 PolarHBondContact O-N 2.72Å; K533-F536 PolarHBondContact O-N 3.46Å; K533-Q537 WeakPolarHBondContact O-CB 3.36Å; K533-Q537 PolarHBondContact O-N 3.39Å
534	S	93.7	Very high	90.1	Very high	22 Å²	22	72.1 Å²	72.1	15%	0.154	35%	0.348	C	S	.	.	H	α-helix	trans	-66.1	-36	178.3	-164	0	0	0	0	112	K290 N530 H531 V532 N538	K290-S534 PolarHBondContact NZ-OG 3.15Å; N530-S534 VanDerWaalsContact O-CB 3.3Å; N530-S534 WeakPolarHBondContact O-CB 3.32Å; N530-S534 PolarHBondContact O-N 2.98Å; H531-S534 CarbonylContact O-C 3.46Å; H531-S534 PolarHBondContact O-N 2.96Å; V532-S534 VanDerWaalsContact C-N 3.29Å; V532-S534 PolarHBondContact O-N 3.09Å; S534-N538 PolarHBondContact O-N 2.84Å; S534-N538 PolarHBondContact O-ND2 2.95Å
535	C	94.4	Very high	88	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62	-47.1	173.3	-72.9	0	0	0	0	112.1	K290 R293 M520 L523 H531 V532 K533 N538 M539	K290-C535 HydrophobicContact CB-CB 4.46Å; K290-C535 VanDerWaalsContact CB-SG 3.52Å; R293-C535 VanDerWaalsContact NH1-CB 3.3Å; R293-C535 PolarHBondContact NH1-SG 2.79Å; M520-C535 HydrophobicContact CE-CB 3.34Å; M520-C535 HydrophobicContact SD-CB 4.12Å; L523-C535 HydrophobicContact CD1-CB 4.17Å; H531-C535 VanDerWaalsContact CE1-SG 3.56Å; H531-C535 PolarHBondContact O-N 3.3Å; H531-C535 PolarHBondContact O-SG 3.26Å; V532-C535 WeakPolarHBondContact O-CB 3.48Å; V532-C535 PolarHBondContact O-N 2.91Å; V532-C535 VanDerWaalsContact O-N 3.14Å; K533-C535 PolarHBondContact O-N 2.72Å; C535-N538 PolarHBondContact O-N 3.3Å; C535-M539 WeakPolarHBondContact O-CG 3.46Å; C535-M539 PolarHBondContact O-N 2.96Å; C535-M539 VanDerWaalsContact O-N 3.16Å
536	F	94.7	Very high	85.4	Confident	73 Å²	73	75.4 Å²	75.4	32%	0.32	36%	0.357	S	S	.	.	H	α-helix	trans	-65.9	-42.5	179.4	-80.3	-66.1	0	0	0	111	M520 L524 V532 K533 N538 M539 E540	M520-F536 HydrophobicContact CB-CE1 4.07Å; M520-F536 HydrophobicContact CB-CZ 4.11Å; M520-F536 HydrophobicContact CE-CB 4.2Å; M520-F536 HydrophobicContact CE-CD1 3.44Å; M520-F536 VanDerWaalsContact CE-CD1 3.44Å; M520-F536 HydrophobicContact CE-CD2 3.5Å; M520-F536 HydrophobicContact CE-CE1 3.53Å; M520-F536 HydrophobicContact CE-CE2 3.6Å; M520-F536 HydrophobicContact CE-CG 3.42Å; M520-F536 VanDerWaalsContact CE-CG 3.42Å; M520-F536 HydrophobicContact CE-CZ 3.61Å; M520-F536 HydrophobicContact SD-CD1 3.95Å; M520-F536 HydrophobicContact SD-CE1 4.07Å; M520-F536 HydrophobicContact SD-CG 4.39Å; L524-F536 HydrophobicContact CD2-CE2 4.41Å; L524-F536 HydrophobicContact CD2-CZ 3.85Å; V532-F536 HydrophobicContact CG1-CD2 3.74Å; V532-F536 HydrophobicContact CG1-CE2 3.56Å; V532-F536 WeakPolarHBondContact O-CD2 3.04Å; V532-F536 PolarHBondContact O-N 3.03Å; K533-F536 PolarHBondContact O-N 3.46Å; F536-N538 VanDerWaalsContact C-N 3.32Å; F536-N538 PolarHBondContact O-N 3.41Å; F536-M539 PolarHBondContact O-N 3.09Å; F536-E540 PolarHBondContact O-N 2.97Å
537	Q	94.5	Very high	82.7	Confident	138 Å²	138	79.5 Å²	79.5	65%	0.645	38%	0.376	S	S	*	.	H	α-helix	trans	-57.6	-40.3	175.9	-172	-176.5	13.6	0	0	112.9	K533 M539 E540	K533-Q537 WeakPolarHBondContact O-CB 3.36Å; K533-Q537 PolarHBondContact O-N 3.39Å; Q537-M539 VanDerWaalsContact C-N 3.34Å; Q537-E540 WeakPolarHBondContact O-CB 3.47Å; Q537-E540 WeakPolarHBondContact O-CG 3.23Å; Q537-E540 PolarHBondContact O-N 2.52Å
538	N	94.3	Very high	80.4	Confident	30 Å²	30	80.6 Å²	80.6	16%	0.16	38%	0.375	C	S	.	.	H	α-helix	trans	-72.3	-27.1	176.7	-78.1	-77.7	0	0	0	112.7	K290 Y291 S534 C535 F536 E540 I541	K290-N538 VanDerWaalsContact O-CB 3.28Å; K290-N538 WeakPolarHBondContact O-CB 3.49Å; Y291-N538 VanDerWaalsContact CD1-OD1 3.31Å; Y291-N538 WeakPolarHBondContact CD1-OD1 3.46Å; Y291-N538 VanDerWaalsContact CE1-OD1 3.32Å; Y291-N538 WeakPolarHBondContact CE1-OD1 3.42Å; S534-N538 PolarHBondContact O-N 2.84Å; S534-N538 PolarHBondContact O-ND2 2.95Å; C535-N538 PolarHBondContact O-N 3.3Å; F536-N538 VanDerWaalsContact C-N 3.32Å; F536-N538 PolarHBondContact O-N 3.41Å; N538-E540 VanDerWaalsContact C-N 3.29Å; N538-E540 PolarHBondContact O-N 3.48Å; N538-I541 WeakPolarHBondContact O-CG2 3.26Å
539	M	94.9	Very high	78.1	Confident	20 Å²	20	83.1 Å²	83.1	10%	0.099	38%	0.38	C	S	.	.	H	α-helix	trans	-78.2	-7	175	-70	-61.2	-71	0	0	114.1	R293 P294 Q297 M520 C535 F536 Q537 I541 C542	R293-M539 HydrophobicContact CB-SD 4.04Å; R293-M539 HydrophobicContact CG-CE 4.16Å; R293-M539 HydrophobicContact CG-CG 4.47Å; R293-M539 HydrophobicContact CG-SD 3.59Å; R293-M539 VanDerWaalsContact CG-SD 3.59Å; P294-M539 HydrophobicContact CB-SD 3.93Å; P294-M539 HydrophobicContact CG-SD 4.46Å; Q297-M539 HydrophobicContact CB-CE 4.07Å; Q297-M539 HydrophobicContact CG-CE 4.08Å; M520-M539 HydrophobicContact SD-CB 4.37Å; M520-M539 HydrophobicContact SD-CG 3.64Å; C535-M539 WeakPolarHBondContact O-CG 3.46Å; C535-M539 PolarHBondContact O-N 2.96Å; C535-M539 VanDerWaalsContact O-N 3.16Å; F536-M539 PolarHBondContact O-N 3.09Å; Q537-M539 VanDerWaalsContact C-N 3.34Å; M539-I541 PolarHBondContact O-N 3.42Å; M539-C542 HydrophobicContact CE-CB 4.15Å; M539-C542 WeakPolarHBondContact O-CB 3.22Å; M539-C542 PolarHBondContact O-N 3.21Å; M539-C542 VanDerWaalsContact O-N 3.08Å
540	E	92.4	Very high	75.3	Confident	93 Å²	93	88 Å²	88	44%	0.435	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-60	-27.7	172.5	-59.4	-58.2	147.6	0	0	112.4	F536 Q537 N538 C542 K543	F536-E540 PolarHBondContact O-N 2.97Å; Q537-E540 WeakPolarHBondContact O-CB 3.47Å; Q537-E540 WeakPolarHBondContact O-CG 3.23Å; Q537-E540 PolarHBondContact O-N 2.52Å; N538-E540 VanDerWaalsContact C-N 3.29Å; N538-E540 PolarHBondContact O-N 3.48Å; E540-C542 PolarHBondContact O-N 3.02Å; E540-K543 PolarHBondContact O-N 2.98Å; E540-K543 WeakPolarHBondContact OE1-CE 3.31Å; E540-K543 IonicContact OE1-NZ 2.76Å; E540-K543 PolarHBondContact OE1-NZ 2.8Å; E540-K543 VanDerWaalsContact OE2-CD 3.28Å; E540-K543 WeakPolarHBondContact OE2-CD 3.3Å; E540-K543 WeakPolarHBondContact OE2-CE 3.22Å; E540-K543 IonicContact OE2-NZ 2.73Å; E540-K543 PolarHBondContact OE2-NZ 2.84Å
541	I	92.1	Very high	72.8	Confident	42 Å²	42	87.1 Å²	87.1	22%	0.215	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-66.1	-26.4	176.2	-160.6	61	0	0	0	112.8	P294 Q329 R332 N538 M539	P294-I541 HydrophobicContact CB-CG2 3.69Å; Q329-I541 HydrophobicContact CB-CD1 4.4Å; R332-I541 HydrophobicContact CB-CD1 4.13Å; R332-I541 HydrophobicContact CB-CG1 3.83Å; R332-I541 HydrophobicContact CG-CG1 4.26Å; N538-I541 WeakPolarHBondContact O-CG2 3.26Å; M539-I541 PolarHBondContact O-N 3.42Å
542	C	90.5	Very high	70.3	Confident	28 Å²	28	91.5 Å²	91.5	19%	0.189	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-86.2	-12.8	178.3	-65.6	0	0	0	0	113.2	P294 Q297 M539 E540	P294-C542 VanDerWaalsContact CA-SG 3.53Å; P294-C542 VanDerWaalsContact CB-SG 3.59Å; Q297-C542 HydrophobicContact CG-CB 4.26Å; Q297-C542 VanDerWaalsContact OE1-CB 3.32Å; Q297-C542 PolarHBondContact OE1-SG 2.75Å; M539-C542 HydrophobicContact CE-CB 4.15Å; M539-C542 WeakPolarHBondContact O-CB 3.22Å; M539-C542 PolarHBondContact O-N 3.21Å; M539-C542 VanDerWaalsContact O-N 3.08Å; E540-C542 PolarHBondContact O-N 3.02Å
543	K	82.6	Confident	67.4	Low	115 Å²	115	96 Å²	96	50%	0.5	46%	0.464	S	S	.	.	S	Bend	trans	-77.6	133	177.5	-63.1	-170.6	-162.7	161.6	0	109.6	E540 R545	E540-K543 PolarHBondContact O-N 2.98Å; E540-K543 WeakPolarHBondContact OE1-CE 3.31Å; E540-K543 IonicContact OE1-NZ 2.76Å; E540-K543 PolarHBondContact OE1-NZ 2.8Å; E540-K543 VanDerWaalsContact OE2-CD 3.28Å; E540-K543 WeakPolarHBondContact OE2-CD 3.3Å; E540-K543 WeakPolarHBondContact OE2-CE 3.22Å; E540-K543 IonicContact OE2-NZ 2.73Å; E540-K543 PolarHBondContact OE2-NZ 2.84Å; K543-R545 PolarHBondContact O-N 3.23Å
544	R	60.6	Low	64.6	Low	208 Å²	208	99.5 Å²	99.5	79%	0.785	48%	0.482	S	S	*	.			trans	-55.8	108.9	177.2	-76.7	-175.8	-71.9	179.5	-1.6	110.5	V546	R544-V546 PolarHBondContact O-N 3.4Å
545	R	48.7	Very low	62	Low	184 Å²	184	105 Å²	105	69%	0.694	51%	0.508	S	S	*	.			trans	-66.2	96.8	165.6	-75.1	-170.2	-179.7	-170.2	2.1	109	K543 H547	K543-R545 PolarHBondContact O-N 3.23Å; R545-H547 PolarHBondContact O-N 3.03Å
546	V	35.6	Very low	58.9	Low	124 Å²	124	114.1 Å²	114.1	75%	0.752	55%	0.548	S	S	*	.			trans	-67.5	100.8	163.8	-177.7	0	0	0	0	107.7	R544 M548	R544-V546 PolarHBondContact O-N 3.4Å; V546-M548 PolarHBondContact O-N 3Å
547	H	36.3	Very low	55.8	Low	130 Å²	130	116 Å²	116	60%	0.602	57%	0.57	S	S	*	*			trans	41.1	68.6	162.6	-62.8	90.7	0	0	0	117.8	R545 Y549	R545-H547 PolarHBondContact O-N 3.03Å; H547-Y549 PolarHBondContact O-N 3.03Å; H547-Y549 VanDerWaalsContact O-N 3.15Å
548	M	36.6	Very low	53.5	Low	109 Å²	109	113.7 Å²	113.7	54%	0.537	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.9	0.2	164.4	-79.5	-97.2	66.5	0	0	114.3	V546	V546-M548 PolarHBondContact O-N 3Å
549	Y	38.5	Very low	50.3	Low	205 Å²	205	121.1 Å²	121.1	80%	0.804	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-22	179.7	-81.2	-78.3	0	0	0	114.2	H547	H547-Y549 PolarHBondContact O-N 3.03Å; H547-Y549 VanDerWaalsContact O-N 3.15Å
550	D	34.5	Very low	47	Very low	102 Å²	102	125.3 Å²	125.3	55%	0.545	63%	0.625	S	S	.	*	H	α-helix	trans	-71.5	-33.3	175.7	-80.4	-55.7	0	0	0	112.6	V552 S553	D550-V552 PolarHBondContact O-N 2.87Å; D550-V552 VanDerWaalsContact O-N 3.15Å; D550-S553 PolarHBondContact O-N 2.74Å; D550-S553 VanDerWaalsContact O-N 3.09Å
551	T	36.9	Very low	44	Very low	77 Å²	77	126.4 Å²	126.4	47%	0.472	64%	0.638	S	S	.	*	H	α-helix	trans	-62.9	-24.2	-177.5	-34	0	0	0	0	113
552	V	37.3	Very low	40.9	Very low	113 Å²	113	132.8 Å²	132.8	69%	0.685	67%	0.666	S	S	*	*	H	α-helix	trans	-82.3	-23.5	179.3	-175.9	0	0	0	0	112	D550	D550-V552 PolarHBondContact O-N 2.87Å; D550-V552 VanDerWaalsContact O-N 3.15Å
553	S	34	Very low	37.9	Very low	100 Å²	100	137.5 Å²	137.5	70%	0.699	69%	0.694	S	S	*	*	H	α-helix	trans	-80.7	-17.7	-177.6	-67.3	0	0	0	0	114.6	D550	D550-S553 PolarHBondContact O-N 2.74Å; D550-S553 VanDerWaalsContact O-N 3.09Å
554	Q	33.7	Very low	35.2	Very low	176 Å²	176	136.2 Å²	136.2	82%	0.822	71%	0.705	S	S	*	*	S	Bend	trans	-95.3	-11.3	-177.3	-66.5	-167.4	-6	0	0	114.8	K556	Q554-K556 PolarHBondContact O-N 2.96Å
555	I	38.9	Very low	34.2	Very low	138 Å²	138	131.2 Å²	131.2	71%	0.708	70%	0.699	S	S	*	*			trans	-92.5	79.1	-175.9	-52.1	-179.3	0	0	0	110.8
556	K	29.7	Very low	33.2	Very low	192 Å²	192	129 Å²	129	84%	0.835	70%	0.701	S	S	*	*			trans	-131	80.2	165.7	-82.7	-169.2	174.7	179.3	0	112.5	Q554	Q554-K556 PolarHBondContact O-N 2.96Å
557	S	28.3	Very low	32.9	Very low	111 Å²	111	128.9 Å²	128.9	78%	0.776	70%	0.701	S	S	*	*			trans	67.3	163.2	154.9	83.4	0	0	0	0	118.5
558	P	47.2	Very low	32.5	Very low	91 Å²	91	127.5 Å²	127.5	59%	0.591	71%	0.706	S	S	*	*			cis	-131.5	-164.6	-34.8	25.1	-2.9	0	0	0	112.9
559	F	27.1	Very low	32.2	Very low	186 Å²	186	127.9 Å²	127.9	82%	0.816	72%	0.715	S	S	*	*			trans	82.4	146	170.7	-54.6	-76.1	0	0	0	117.9
560	T	25.8	Very low	31.8	Very low	107 Å²	107	125.2 Å²	125.2	66%	0.656	71%	0.714	S	S	*	*			cis	-168.5	135.9	-38.3	-104.6	0	0	0	0	109.3
561	T	28.2	Very low	31.5	Very low	116 Å²	116	127.2 Å²	127.2	71%	0.712	72%	0.724	S	S	*	*			trans	56.4	163	172.2	44.8	0	0	0	0	118.2
562	H	28.2	Very low	31	Very low	176 Å²	176	128.7 Å²	128.7	82%	0.815	73%	0.734	S	S	*	*			cis	-130.8	-174	6.4	-117.2	-62	0	0	0	113
563	V	27.8	Very low	30.4	Very low	127 Å²	127	130.9 Å²	130.9	77%	0.77	74%	0.738	S	S	*	*			trans	-112.6	124.1	-163.5	171.8	0	0	0	0	112.7
564	A	25.6	Very low	30	Very low	88 Å²	88	131.4 Å²	131.4	73%	0.727	74%	0.742	S	S	*	*			trans	39.6	-178.6	135.9	0	0	0	0	0	121.2
565	P	39.7	Very low	29.5	Very low	103 Å²	103	132.2 Å²	132.2	67%	0.669	74%	0.743	S	S	*	*			cis	-136.6	-171.4	-7.5	43.8	-26.2	0	0	0	116
566	N	28.1	Very low	28.9	Very low	138 Å²	138	131.4 Å²	131.4	74%	0.738	75%	0.75	S	S	*	*			trans	86.1	127	145.6	-71.6	-7.7	0	0	0	124.6
567	T	28.2	Very low	28.7	Very low	121 Å²	121	129.5 Å²	129.5	74%	0.742	75%	0.748	S	S	*	*			trans	68.5	104	134.6	57.5	0	0	0	0	124
568	S	28.9	Very low	28.8	Very low	101 Å²	101	131.8 Å²	131.8	71%	0.706	75%	0.747	S	S	*	*				74.3	135.5	120.2	67.1	0	0	0	0	124.5
569	T	29.9	Very low	27.8	Very low	118 Å²	118	135.8 Å²	135.8	72%	0.724	76%	0.762	S	S	*	*			trans	74.4	107.9	144.1	45.3	0	0	0	0	122.6
570	N	29.5	Very low	27.8	Very low	148 Å²	148	132.9 Å²	132.9	79%	0.791	76%	0.755	S	S	*	*				86.6	143.7	126.2	-87.2	-39.3	0	0	0	123.3
571	L	27.7	Very low	27.9	Very low	145 Å²	145	134.7 Å²	134.7	76%	0.759	77%	0.766	S	S	*	*			trans	74.7	108.2	156.3	-68.7	161.7	0	0	0	120.4
572	T	26.5	Very low	27.9	Very low	108 Å²	108	135 Å²	135	66%	0.663	77%	0.768	S	S	*	*				43.1	118.7	124.5	-48	0	0	0	0	119.7
573	M	25.6	Very low	28.1	Very low	159 Å²	159	132.7 Å²	132.7	78%	0.783	76%	0.757	S	S	*	*			trans	-126.1	123.9	154.7	-80.2	-67.1	148.9	0	0	111.3	F575	M573-F575 HydrophobicContact CB-CE2 4.38Å
574	S	24.8	Very low	28	Very low	110 Å²	110	133.4 Å²	133.4	77%	0.769	76%	0.757	S	S	*	*			trans	-81.1	141.8	171	-56.1	0	0	0	0	110.1
575	F	24.1	Very low	28.1	Very low	194 Å²	194	136 Å²	136	85%	0.851	75%	0.754	S	S	*	*			trans	-116.7	104.6	177.3	-85.6	-82.5	0	0	0	113	M573	M573-F575 HydrophobicContact CB-CE2 4.38Å
576	S	25.3	Very low	27.6	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	76%	0.761	S	S	*	*			trans	-167.4	147	156.6	-77.4	0	0	0	0	106.6
577	N	26.6	Very low	27.7	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	76%	0.761	S	S	*	*			cis	-142.3	171.8	14.2	-160.2	1.4	0	0	0	111.4
578	Q	29.2	Very low	27.7	Very low	159 Å²	159	134.2 Å²	134.2	74%	0.743	76%	0.76	S	S	*	*			trans	-78.9	161.7	172.3	-61	175.9	-7.5	0	0	112.3
579	L	27.3	Very low	27.8	Very low	174 Å²	174	137.3 Å²	137.3	91%	0.911	77%	0.768	S	S	*	*			trans	-152.3	145.7	145.5	-116.7	172.4	0	0	0	111.3
580	N	27.5	Very low	27.8	Very low	125 Å²	125	135.4 Å²	135.4	67%	0.668	76%	0.764	S	S	*	*			trans	-102.6	166.9	-177.9	-71.9	-52.9	0	0	0	111.7	V582	N580-V582 HydrophobicContact CB-CG2 4.3Å
581	T	27.4	Very low	27.8	Very low	145 Å²	145	133.4 Å²	133.4	89%	0.89	76%	0.761	S	S	*	*			trans	-120.7	144.4	159.1	-47.3	0	0	0	0	109.8
582	V	28.1	Very low	27.9	Very low	122 Å²	122	131.5 Å²	131.5	74%	0.739	76%	0.761	S	S	*	*			trans	-159.1	164.3	-161.4	-121.5	0	0	0	0	109	N580	N580-V582 HydrophobicContact CB-CG2 4.3Å
583	H	31.9	Very low	28	Very low	128 Å²	128	131.4 Å²	131.4	59%	0.593	76%	0.764	S	S	*	*			cis	-160.8	147.6	6.9	174.9	49.8	0	0	0	110	Q585	H583-Q585 PolarHBondContact CD2-NE2 3.45Å; H583-Q585 VanDerWaalsContact CD2-NE2 3.3Å; H583-Q585 VanDerWaalsContact NE2-CG 3.25Å; H583-Q585 WeakPolarHBondContact NE2-CG 3.38Å; H583-Q585 PolarHBondContact NE2-NE2 2.83Å
584	N	26.3	Very low	28.1	Very low	143 Å²	143	130 Å²	130	77%	0.765	76%	0.764	S	S	*	*			trans	-160.9	124.6	148.3	-92.9	-24.5	0	0	0	107.8
585	Q	28.5	Very low	28.4	Very low	143 Å²	143	129.4 Å²	129.4	67%	0.668	77%	0.767	S	S	*	*				75.4	126.4	53.3	-64.1	-169.4	9	0	0	112.9	H583	H583-Q585 PolarHBondContact CD2-NE2 3.45Å; H583-Q585 VanDerWaalsContact CD2-NE2 3.3Å; H583-Q585 VanDerWaalsContact NE2-CG 3.25Å; H583-Q585 WeakPolarHBondContact NE2-CG 3.38Å; H583-Q585 PolarHBondContact NE2-NE2 2.83Å
586	A	28.5	Very low	28.6	Very low	100 Å²	100	125 Å²	125	83%	0.826	77%	0.766	S	S	*	*			cis	-144.1	-179.5	-3.4	0	0	0	0	0	109
587	S	29.3	Very low	29	Very low	103 Å²	103	124.2 Å²	124.2	72%	0.72	77%	0.767	S	S	*	*			cis	-141.7	-176	13.1	59.7	0	0	0	0	109.3
588	V	29.4	Very low	29	Very low	120 Å²	120	122 Å²	122	73%	0.727	77%	0.769	S	S	*	*			cis	69.8	130	26.7	-162.3	0	0	0	0	111.9
589	L	30.7	Very low	28.8	Very low	166 Å²	166	120.6 Å²	120.6	87%	0.869	77%	0.772	S	S	*	*			cis	-130	163.4	31.9	-69.4	155.5	0	0	0	111.8
590	A	30.3	Very low	28.7	Very low	79 Å²	79	120 Å²	120	65%	0.653	77%	0.769	S	S	*	*			cis	-167.5	169.9	-19.7	0	0	0	0	0	106.9
591	S	29.4	Very low	28.5	Very low	105 Å²	105	119 Å²	119	73%	0.734	77%	0.771	S	S	*	*			cis	-149.4	137	22.2	-56.2	0	0	0	0	113
592	S	28.7	Very low	28.4	Very low	106 Å²	106	120.5 Å²	120.5	74%	0.741	77%	0.773	S	S	*	*			trans	16.6	146.7	136.8	59.3	0	0	0	0	121.2
593	S	29.9	Very low	28.2	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	78%	0.776	S	S	*	*			cis	-177.7	170.9	2	39.5	0	0	0	0	110
594	T	27.9	Very low	28	Very low	128 Å²	128	120.6 Å²	120.6	79%	0.785	79%	0.788	S	S	*	*			cis	160.3	156.8	-19.9	-60.9	0	0	0	0	104.3
595	A	29.8	Very low	28	Very low	99 Å²	99	119.8 Å²	119.8	82%	0.818	79%	0.793	S	S	*	*			trans	72	159.6	164.3	0	0	0	0	0	117.6
596	A	28.8	Very low	27.8	Very low	100 Å²	100	120.2 Å²	120.2	83%	0.826	80%	0.8	S	S	*	*			cis	-164.7	169.3	-30.2	0	0	0	0	0	108.8
597	A	32.9	Very low	27.6	Very low	106 Å²	106	121.4 Å²	121.4	88%	0.876	80%	0.796	S	S	*	*			trans	-86.2	140.9	179.2	0	0	0	0	0	113.3
598	A	28.1	Very low	27.5	Very low	104 Å²	104	121.5 Å²	121.5	86%	0.86	80%	0.797	S	S	*	*			trans	-150.9	146	163.6	0	0	0	0	0	110.4
599	T	25.1	Very low	27.2	Very low	130 Å²	130	122.9 Å²	122.9	80%	0.798	80%	0.8	S	S	*	*			trans	-101.4	140.3	175.9	43.3	0	0	0	0	111
600	L	24	Very low	27	Very low	163 Å²	163	122.2 Å²	122.2	85%	0.853	80%	0.796	S	S	*	*				165.4	163.3	129.7	-90.5	164.9	0	0	0	114.4
601	S	22.9	Very low	26.6	Very low	102 Å²	102	125.9 Å²	125.9	71%	0.713	81%	0.805	S	S	*	*			trans	48.7	93.4	151.5	59.7	0	0	0	0	121.1
602	L	25.1	Very low	26.3	Very low	178 Å²	178	129.5 Å²	129.5	93%	0.932	80%	0.803	S	S	*	*				10.5	113.6	113.8	-170.8	83.9	0	0	0	118.1
603	A	24.4	Very low	26.1	Very low	97 Å²	97	132.3 Å²	132.3	80%	0.802	81%	0.805	S	S	*	*			trans	-168.5	155.8	146.1	0	0	0	0	0	111.7
604	N	27.5	Very low	25.9	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	80%	0.802	S	S	*	*			trans	-83	152.7	174.2	-57.4	-32.5	0	0	0	111.7
605	S	26.9	Very low	25.7	Very low	125 Å²	125	130 Å²	130	87%	0.874	80%	0.8	S	S	*	*			trans	-163	142.1	147.8	-78.9	0	0	0	0	112
606	D	24.1	Very low	25.5	Very low	153 Å²	153	133.4 Å²	133.4	82%	0.818	80%	0.803	S	S	*	*			trans	-88.5	172.2	-174.5	-75.3	-78.8	0	0	0	115.3
607	V	25.3	Very low	25.4	Very low	124 Å²	124	138.6 Å²	138.6	75%	0.752	80%	0.803	S	S	*	*			trans	77.3	95	144	161.1	0	0	0	0	120.3
608	S	25.4	Very low	25.6	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	80%	0.8	S	S	*	*				68.9	161.8	116.8	-49.9	0	0	0	0	124.9
609	L	23.6	Very low	25.4	Very low	150 Å²	150	139.6 Å²	139.6	79%	0.785	79%	0.794	S	S	*	*			trans	91.7	103.4	157	-67	171.4	0	0	0	120.9
610	L	26.1	Very low	25.9	Very low	151 Å²	151	138.9 Å²	138.9	79%	0.791	79%	0.794	S	S	*	*				39.6	118	127.7	-66.4	176.7	0	0	0	121.5
611	N	23.7	Very low	26	Very low	156 Å²	156	134 Å²	134	83%	0.834	78%	0.778	S	S	*	*			trans	-168.4	164.3	130.6	-105.1	-6.8	0	0	0	108.6
612	Y	23	Very low	26.7	Very low	181 Å²	181	133.5 Å²	133.5	71%	0.71	78%	0.78	S	S	*	*			cis	-173	138.8	-41.1	-150.4	-101.1	0	0	0	105.8
613	Q	22.9	Very low	27.3	Very low	165 Å²	165	130.8 Å²	130.8	77%	0.771	77%	0.773	S	S	*	*			trans	62.3	161.2	169.5	-80.3	171	-11.2	0	0	117.2
614	S	25.5	Very low	27.7	Very low	98 Å²	98	133 Å²	133	69%	0.685	78%	0.776	S	S	*	*			cis	-156.4	157.8	-3.6	-124	0	0	0	0	112.5
615	A	25	Very low	28	Very low	89 Å²	89	131.7 Å²	131.7	74%	0.736	78%	0.776	S	S	*	*			trans	61.9	144.9	156.3	0	0	0	0	0	119.7
616	L	24.3	Very low	28	Very low	170 Å²	170	129.1 Å²	129.1	89%	0.89	77%	0.769	S	S	*	*			cis	-155.2	143.1	-11	-111	166.6	0	0	0	109.2
617	Y	27.1	Very low	28.1	Very low	208 Å²	208	128.7 Å²	128.7	82%	0.816	77%	0.772	S	S	*	*			trans	-89.1	175.2	166.2	-96.5	-68.5	0	0	0	109.7
618	P	37.3	Very low	28.1	Very low	125 Å²	125	127.1 Å²	127.1	81%	0.812	77%	0.771	S	S	*	*			cis	-136.9	-163.9	26	40	-19	0	0	0	115
619	S	25.4	Very low	28.1	Very low	107 Å²	107	130.8 Å²	130.8	75%	0.748	78%	0.777	S	S	*	*				-168.3	178.7	-53	-166.6	0	0	0	0	108.9
620	S	35.4	Very low	28.2	Very low	114 Å²	114	132.8 Å²	132.8	80%	0.797	78%	0.782	S	S	*	*			trans	-105.3	147.1	-171.8	176.1	0	0	0	0	114.5
621	A	24.4	Very low	28.1	Very low	62 Å²	62	128.7 Å²	128.7	51%	0.512	78%	0.777	S	S	.	*			trans	-163.2	144.2	154.2	0	0	0	0	0	114.4	G1039	A621-G1039 VanDerWaalsContact CB-O 3.31Å; A621-G1039 WeakPolarHBondContact CB-O 3.35Å
622	A	37.5	Very low	28.1	Very low	90 Å²	90	128.7 Å²	128.7	74%	0.744	78%	0.782	S	S	*	*			trans	-107.5	179.3	157.6	0	0	0	0	0	108.2
623	P	39.3	Very low	28.1	Very low	122 Å²	122	124.5 Å²	124.5	79%	0.792	78%	0.779	S	S	*	*			cis	-133	178.6	13	39.3	-19	0	0	0	116.1
624	V	32.3	Very low	28.1	Very low	143 Å²	143	124.5 Å²	124.5	87%	0.867	78%	0.783	S	S	*	*			trans	-140.9	134.7	-170.3	-174.9	0	0	0	0	114.2
625	P	34	Very low	28.2	Very low	128 Å²	128	127.9 Å²	127.9	83%	0.831	79%	0.789	S	S	*	*			trans	-129.9	179.7	173.2	42.5	-29.9	0	0	0	115.5
626	G	25.6	Very low	28.5	Very low	70 Å²	70	129.5 Å²	129.5	72%	0.722	79%	0.792	S	S	*	*			trans	126.3	74.8	143	0	0	0	0	0	123.2
627	V	26.6	Very low	28.5	Very low	145 Å²	145	124.1 Å²	124.1	88%	0.879	78%	0.777	S	S	*	*			trans	51.2	110.2	133.7	-174.3	0	0	0	0	123.5
628	A	25.8	Very low	28.3	Very low	90 Å²	90	120.8 Å²	120.8	74%	0.744	78%	0.779	S	S	*	*			trans	54.6	137.6	131.6	0	0	0	0	0	127
629	Q	25.3	Very low	27.7	Very low	183 Å²	183	121.4 Å²	121.4	86%	0.855	78%	0.78	S	S	*	*				-144.2	140.9	118.6	-67.4	-159	-8.8	0	0	107.3
630	Q	25.9	Very low	27.8	Very low	192 Å²	192	124.8 Å²	124.8	90%	0.897	78%	0.784	S	S	*	*				63.1	126.1	60.2	-85.2	-172.3	-18.5	0	0	114.9
631	G	24.3	Very low	27.3	Very low	65 Å²	65	127.1 Å²	127.1	67%	0.67	79%	0.786	S	S	*	*			cis	175.1	-163	-4.3	0	0	0	0	0	112.6
632	V	23.6	Very low	27.2	Very low	155 Å²	155	129.4 Å²	129.4	94%	0.939	80%	0.797	S	S	*	*			trans	73.7	138.5	164	-177.4	0	0	0	0	115.7
633	S	21.8	Very low	26.6	Very low	94 Å²	94	130.9 Å²	130.9	66%	0.657	80%	0.797	S	S	*	*			cis	-163.1	152	-12.7	168	0	0	0	0	113.3
634	L	23.6	Very low	25.9	Very low	164 Å²	164	133.4 Å²	133.4	86%	0.859	80%	0.798	S	S	*	*			trans	18.6	144.5	151.6	-58.1	166.2	0	0	0	124.8
635	Q	27.1	Very low	25.5	Very low	170 Å²	170	132.9 Å²	132.9	79%	0.794	80%	0.796	S	S	*	*			trans	-42	165.5	148.5	-72.3	-81.9	-13	0	0	114.3
636	P	31.7	Very low	25.2	Very low	123 Å²	123	134.7 Å²	134.7	80%	0.799	80%	0.798	S	S	*	*			cis	-153.5	-177.9	35.8	44.3	-23.4	0	0	0	119.8
637	G	23.7	Very low	25.4	Very low	57 Å²	57	135.7 Å²	135.7	59%	0.588	79%	0.792	S	S	*	*				114.8	125.7	129.5	0	0	0	0	0	121.5
638	T	23.8	Very low	25.5	Very low	138 Å²	138	139.4 Å²	139.4	85%	0.847	80%	0.797	S	S	*	*			trans	42	143.5	139.1	51	0	0	0	0	121.6
639	T	25.1	Very low	25.7	Very low	138 Å²	138	143.6 Å²	143.6	85%	0.847	80%	0.801	S	S	*	*			cis	-159.3	175.4	35.3	-30	0	0	0	0	112
640	Q	26.4	Very low	25.7	Very low	178 Å²	178	143 Å²	143	83%	0.832	80%	0.798	S	S	*	*			trans	-86.3	166	-179.7	-58.3	175.7	-12.2	0	0	114.7
641	I	25.7	Very low	25.7	Very low	162 Å²	162	139.9 Å²	139.9	83%	0.831	79%	0.792	S	S	*	*			trans	177	136.1	130.6	-94.1	157.2	0	0	0	112.7
642	C	23.1	Very low	25.7	Very low	110 Å²	110	145.5 Å²	145.5	74%	0.743	80%	0.798	S	S	*	*			trans	45.9	149.7	155.8	-78.3	0	0	0	0	124
643	T	24.1	Very low	25.8	Very low	121 Å²	121	145 Å²	145	74%	0.742	79%	0.789	S	S	*	*			cis	-169.4	163.6	-28.1	12.5	0	0	0	0	109.2
644	Q	23.4	Very low	25.9	Very low	176 Å²	176	146.8 Å²	146.8	82%	0.822	80%	0.796	S	S	*	*			trans	66.6	98.3	171.5	-69	-174.2	5.9	0	0	116
645	T	24.7	Very low	25.8	Very low	132 Å²	132	144.4 Å²	144.4	81%	0.81	79%	0.791	S	S	*	*				86.6	94.9	66.8	58.1	0	0	0	0	114.8
646	D	28	Very low	27.1	Very low	165 Å²	165	142 Å²	142	88%	0.882	79%	0.791	S	S	*	*			trans	-150.7	140.3	133.8	-138.9	-4.9	0	0	0	108.9
647	P	30.6	Very low	27.4	Very low	91 Å²	91	141.8 Å²	141.8	59%	0.591	79%	0.789	S	S	*	*			trans	-117.7	141.3	-164.3	38.6	-27.3	0	0	0	115.2
648	F	28.8	Very low	27.6	Very low	224 Å²	224	143.4 Å²	143.4	98%	0.982	80%	0.797	S	S	*	*			trans	-135.6	134.7	155.2	-95.1	-82.6	0	0	0	110.8
649	Q	28.2	Very low	27.8	Very low	178 Å²	178	146.4 Å²	146.4	83%	0.832	80%	0.799	S	S	*	*			trans	-120.2	166.3	-162.6	-82	-159.5	-0.9	0	0	115.3
650	Q	25.5	Very low	28	Very low	171 Å²	171	148.8 Å²	148.8	80%	0.799	80%	0.8	S	S	*	*			trans	-77	125.8	171.9	173.3	-175	6.1	0	0	112.2
651	T	26.4	Very low	28.1	Very low	125 Å²	125	146.8 Å²	146.8	77%	0.767	80%	0.8	S	S	*	*			trans	-151.8	132.6	163.2	25.6	0	0	0	0	107.5
652	F	24.1	Very low	28.3	Very low	183 Å²	183	142.2 Å²	142.2	80%	0.803	79%	0.794	S	S	*	*				66.2	140.2	60.3	-94.8	-71.7	0	0	0	115.3
653	I	27.1	Very low	28.7	Very low	145 Å²	145	145.4 Å²	145.4	74%	0.744	80%	0.802	S	S	*	*			trans	72.2	116.1	164.7	-66.4	163.2	0	0	0	113.7
654	V	23.1	Very low	28.7	Very low	132 Å²	132	149 Å²	149	80%	0.8	81%	0.811	S	S	*	*				81.8	142.3	62.9	169.8	0	0	0	0	113.4
655	C	22.3	Very low	29	Very low	113 Å²	113	144.5 Å²	144.5	76%	0.764	80%	0.804	S	S	*	*			trans	-70.8	176.7	-176.8	-45.8	0	0	0	0	114.1
656	P	53.8	Low	29	Very low	121 Å²	121	144.8 Å²	144.8	79%	0.786	81%	0.805	S	S	*	*			cis	-114	-121.6	-23.7	23.1	1.6	0	0	0	109.7
657	P	38.5	Very low	29	Very low	118 Å²	118	141.4 Å²	141.4	77%	0.766	80%	0.8	S	S	*	*			cis	-131.9	-173.3	36.9	41.1	-22.3	0	0	0	115.1
658	A	26.6	Very low	28.8	Very low	91 Å²	91	145.2 Å²	145.2	75%	0.752	81%	0.807	S	S	*	*			trans	-93.1	169.7	175.5	0	0	0	0	0	112.9
659	F	29.4	Very low	28.8	Very low	201 Å²	201	142.4 Å²	142.4	88%	0.882	80%	0.797	S	S	*	*			trans	-113	121.5	163.7	-95.4	-82.3	0	0	0	111.7
660	Q	27.7	Very low	28.8	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	80%	0.799	S	S	*	*			trans	-93	133	161.5	-69.8	178.2	-18	0	0	109.3
661	T	30	Very low	28.9	Very low	135 Å²	135	134.9 Å²	134.9	83%	0.828	79%	0.794	S	S	*	*			trans	-152.7	135.7	153.7	-27.3	0	0	0	0	106.9
662	G	29.1	Very low	29.1	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	80%	0.797	S	S	*	*			cis	135.4	108.2	4.5	0	0	0	0	0	108.3
663	L	30.7	Very low	30	Very low	177 Å²	177	135.6 Å²	135.6	93%	0.927	80%	0.8	S	S	*	*			trans	-70.1	131.2	-178.3	-73.5	163.1	0	0	0	111.1
664	Q	25.4	Very low	30.2	Very low	196 Å²	196	133.9 Å²	133.9	92%	0.916	80%	0.795	S	S	*	*				-172.6	167.2	123.8	-106	177.9	16.2	0	0	112.1
665	A	28.5	Very low	30.5	Very low	82 Å²	82	139.4 Å²	139.4	68%	0.678	80%	0.802	S	S	*	*			trans	-131.2	153.2	171.6	0	0	0	0	0	109.2
666	T	26.3	Very low	30.9	Very low	138 Å²	138	140.9 Å²	140.9	85%	0.847	80%	0.8	S	S	*	*			trans	161.9	149.9	135.1	42.1	0	0	0	0	112.7
667	A	26	Very low	29.6	Very low	94 Å²	94	141.8 Å²	141.8	78%	0.777	80%	0.798	S	S	*	*			trans	65.5	159	147.9	0	0	0	0	0	121.5
668	K	26.4	Very low	29.2	Very low	170 Å²	170	142.5 Å²	142.5	74%	0.739	80%	0.795	S	S	*	*			cis	-173.9	147.5	-44.4	-137.1	174.8	173	-171.2	0	110
669	H	30	Very low	29.4	Very low	165 Å²	165	143 Å²	143	76%	0.764	80%	0.799	S	S	*	*			trans	64.2	158.1	172.3	-52.4	-71.5	0	0	0	115.2
670	S	27.9	Very low	29.8	Very low	125 Å²	125	139.4 Å²	139.4	87%	0.874	79%	0.794	S	S	*	*			cis	-145.7	171.9	-7.5	49.9	0	0	0	0	108
671	G	27.4	Very low	30.2	Very low	67 Å²	67	136 Å²	136	69%	0.691	79%	0.787	S	S	*	*			cis	-174.6	-176.6	5.7	0	0	0	0	0	110.5
672	F	30.9	Very low	30.2	Very low	192 Å²	192	136.9 Å²	136.9	84%	0.842	79%	0.786	S	S	*	*			trans	-77.1	162.4	-175.3	-74.1	-91.5	0	0	0	114	V674	F672-V674 HydrophobicContact CD1-CG2 4.03Å
673	P	43.8	Very low	30.3	Very low	131 Å²	131	139.8 Å²	139.8	85%	0.851	79%	0.79	S	S	*	*				-125.9	171.6	92.9	37.8	-32.7	0	0	0	114.8
674	V	29.6	Very low	30.8	Very low	108 Å²	108	137.3 Å²	137.3	66%	0.655	78%	0.784	S	S	*	*			trans	-112.2	146.8	-168.8	170.2	0	0	0	0	111.8	F672	F672-V674 HydrophobicContact CD1-CG2 4.03Å
675	R	30	Very low	30.9	Very low	248 Å²	248	137.2 Å²	137.2	94%	0.936	78%	0.784	S	S	*	*			trans	-153.5	140.6	143.4	-122.7	171.3	-176.2	149.4	3.4	113.3
676	M	30	Very low	31	Very low	145 Å²	145	137.5 Å²	137.5	71%	0.714	79%	0.786	S	S	*	*			trans	-81.4	168.7	169.8	-63.3	163.6	89.5	0	0	107.8
677	D	27.9	Very low	31.3	Very low	140 Å²	140	137.2 Å²	137.2	75%	0.749	79%	0.787	S	S	*	*				-164.2	-170.6	58.4	-130	-63.1	0	0	0	116
678	N	30.6	Very low	31.3	Very low	133 Å²	133	137.8 Å²	137.8	71%	0.711	79%	0.791	S	S	*	*			trans	-93.2	176.1	-159.1	-70.5	-87.6	0	0	0	117.2
679	A	30.7	Very low	31.4	Very low	101 Å²	101	134.3 Å²	134.3	84%	0.835	79%	0.794	S	S	*	*			trans	104.7	161.3	142.5	0	0	0	0	0	120.4
680	V	36.9	Very low	31.2	Very low	126 Å²	126	134.4 Å²	134.4	76%	0.764	80%	0.795	S	S	*	*			trans	-126.5	141.6	-165.8	175	0	0	0	0	110.9
681	P	36.9	Very low	31.3	Very low	115 Å²	115	133.6 Å²	133.6	75%	0.747	79%	0.787	S	S	*	*			trans	-124.1	134.2	142.4	5.7	16.6	0	0	0	110.9
682	I	28.9	Very low	31.2	Very low	155 Å²	155	137.7 Å²	137.7	80%	0.795	79%	0.792	S	S	*	*				90	138.4	60.7	-71.1	168.4	0	0	0	113.6
683	V	30.9	Very low	31	Very low	128 Å²	128	136.7 Å²	136.7	78%	0.776	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-98.7	146.1	-171.4	167.9	0	0	0	0	111.8
684	P	42.5	Very low	30.3	Very low	124 Å²	124	138.7 Å²	138.7	81%	0.805	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-98.8	159	157.1	-7	27.1	0	0	0	113.8
685	Q	27.2	Very low	30	Very low	195 Å²	195	142 Å²	142	91%	0.911	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-100.4	161.2	-159.8	-160.2	170.9	9	0	0	114
686	A	29.1	Very low	29.8	Very low	88 Å²	88	135.4 Å²	135.4	73%	0.727	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.5	162.1	176	0	0	0	0	0	113.3
687	P	32.7	Very low	29.7	Very low	132 Å²	132	131.9 Å²	131.9	86%	0.857	79%	0.792	S	S	*	*			trans	-105.6	160.3	152.4	2.4	19	0	0	0	112
688	A	27.9	Very low	29.8	Very low	106 Å²	106	131.6 Å²	131.6	88%	0.876	80%	0.796	S	S	*	*			trans	-141.6	148.6	-175.2	0	0	0	0	0	114
689	A	28.1	Very low	29.7	Very low	97 Å²	97	132.4 Å²	132.4	80%	0.802	80%	0.799	S	S	*	*			trans	-171.2	151.9	167.3	0	0	0	0	0	108.7
690	Q	25.1	Very low	29.5	Very low	167 Å²	167	132.8 Å²	132.8	78%	0.78	79%	0.791	S	S	*	*			cis	-161.1	136.1	-11.3	-105.7	-80	5	0	0	106.8
691	P	30.6	Very low	28.9	Very low	108 Å²	108	136.1 Å²	136.1	70%	0.701	80%	0.799	S	S	*	*			trans	-106.4	139.6	178.9	36.6	-29.9	0	0	0	114.4
692	L	25.8	Very low	28.5	Very low	153 Å²	153	133.9 Å²	133.9	80%	0.801	80%	0.796	S	S	*	*			trans	-133	116.7	170.4	-69	165.2	0	0	0	107.6
693	Q	26.5	Very low	28.3	Very low	170 Å²	170	131.7 Å²	131.7	79%	0.794	80%	0.795	S	S	*	*				63.7	108.9	71.9	-74.3	-160.8	-20.1	0	0	115.1
694	I	27.3	Very low	28	Very low	173 Å²	173	131.7 Å²	131.7	89%	0.887	80%	0.799	S	S	*	*				-171.4	159.4	111.6	-94.8	161.5	0	0	0	111.1
695	Q	24.6	Very low	27.7	Very low	178 Å²	178	132.3 Å²	132.3	83%	0.832	80%	0.801	S	S	*	*			trans	-95.5	177.9	-174.4	-81	179.9	-10.5	0	0	112.1
696	S	26.4	Very low	28.3	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	79%	0.791	S	S	*	*			cis	-170.8	166.1	-13.6	-102.6	0	0	0	0	110.1
697	G	27.5	Very low	28.2	Very low	70 Å²	70	130.9 Å²	130.9	72%	0.722	79%	0.792	S	S	*	*			trans	110.2	159.7	148.1	0	0	0	0	0	118.3
698	V	28.8	Very low	27.9	Very low	135 Å²	135	132.6 Å²	132.6	82%	0.818	79%	0.791	S	S	*	*			cis	-150.6	155.1	-8	164.8	0	0	0	0	110.4
699	L	28.6	Very low	27.8	Very low	150 Å²	150	134 Å²	134	79%	0.785	79%	0.789	S	S	*	*			trans	-20.6	164.2	153.8	-52.2	172.8	0	0	0	118
700	T	26.1	Very low	27.9	Very low	109 Å²	109	132.9 Å²	132.9	67%	0.669	78%	0.779	S	S	*	*			cis	-176.3	159.3	-3.1	23.1	0	0	0	0	112.1
701	Q	26.4	Very low	28.1	Very low	196 Å²	196	130.2 Å²	130.2	92%	0.916	77%	0.774	S	S	*	*			trans	60.1	163	145.7	-72.7	-168.3	7.8	0	0	122.3
702	G	27.4	Very low	27.9	Very low	68 Å²	68	131 Å²	131	70%	0.701	77%	0.772	S	S	*	*			trans	112.4	75	166.7	0	0	0	0	0	115
703	S	24.6	Very low	28.2	Very low	109 Å²	109	131.5 Å²	131.5	76%	0.762	77%	0.77	S	S	*	*				76.8	110.5	66.4	81	0	0	0	0	116.8
704	C	24	Very low	29.3	Very low	128 Å²	128	127.7 Å²	127.7	87%	0.865	76%	0.76	S	S	*	*			trans	70.1	124.5	148.7	-56.8	0	0	0	0	122
705	T	37.6	Very low	29.3	Very low	136 Å²	136	127.3 Å²	127.3	83%	0.834	75%	0.754	S	S	*	*			trans	-72.2	161.2	161.4	51.4	0	0	0	0	113.3
706	P	39.8	Very low	29.5	Very low	109 Å²	109	126.1 Å²	126.1	71%	0.708	76%	0.759	S	S	*	*				-157.2	159.9	116.1	37.2	-18.4	0	0	0	119.4
707	L	26.2	Very low	29.8	Very low	145 Å²	145	125.1 Å²	125.1	76%	0.759	76%	0.757	S	S	*	*			trans	63.5	134.4	148.2	-63.9	162.9	0	0	0	119.9
708	M	26.4	Very low	29.8	Very low	167 Å²	167	128.5 Å²	128.5	82%	0.823	76%	0.764	S	S	*	*				68.6	141.8	66.1	-59.8	-171.8	82.8	0	0	114.1
709	V	26.8	Very low	29.9	Very low	137 Å²	137	129.1 Å²	129.1	83%	0.83	76%	0.761	S	S	*	*				-164.2	174.9	64.8	163.2	0	0	0	0	111.4
710	A	30.1	Very low	29.9	Very low	73 Å²	73	128.1 Å²	128.1	60%	0.603	76%	0.762	S	S	*	*			trans	-126.1	173.4	179.3	0	0	0	0	0	114.3
711	T	28.8	Very low	31.1	Very low	110 Å²	110	128.1 Å²	128.1	68%	0.675	76%	0.763	S	S	*	*			trans	-159.5	146.9	172.6	5.3	0	0	0	0	115.2	L813	T711-L813 WeakPolarHBondContact O-CD1 3.42Å
712	L	26.9	Very low	31.2	Very low	125 Å²	125	126.2 Å²	126.2	65%	0.654	76%	0.755	S	S	*	*			trans	-104.3	171.6	-172.8	-41.5	80.3	0	0	0	114.3
713	H	31.8	Very low	31.1	Very low	163 Å²	163	133.1 Å²	133.1	76%	0.755	76%	0.761	S	S	*	*			trans	179.6	176.5	133.5	-99.6	72.7	0	0	0	114.3
714	P	49.1	Very low	31.1	Very low	91 Å²	91	132 Å²	132	59%	0.591	76%	0.758	S	S	*	*			trans	-139	-178.3	-133.1	48.3	-30.4	0	0	0	120.2
715	Q	27.1	Very low	31.3	Very low	165 Å²	165	131.7 Å²	131.7	77%	0.771	75%	0.752	S	S	*	*			trans	42.1	135.2	146.6	-74.9	-172.1	-2.3	0	0	124.7
716	V	28.5	Very low	31.4	Very low	152 Å²	152	131.2 Å²	131.2	92%	0.921	75%	0.751	S	S	*	*			trans	-159.2	159.6	144.9	94.9	0	0	0	0	111.6
717	A	32.5	Very low	30.8	Very low	89 Å²	89	133.9 Å²	133.9	74%	0.736	75%	0.752	S	S	*	*			trans	-162.6	166.9	176.8	0	0	0	0	0	114.2
718	T	27.7	Very low	30.9	Very low	142 Å²	142	133.5 Å²	133.5	87%	0.871	76%	0.756	S	S	*	*			trans	-157	177.4	167.7	-17.6	0	0	0	0	113.8
719	I	31.9	Very low	31	Very low	147 Å²	147	130.9 Å²	130.9	75%	0.754	75%	0.745	S	S	*	*			trans	-141.4	179.5	-140.9	-59.9	141.6	0	0	0	112.8
720	T	27.3	Very low	30.9	Very low	130 Å²	130	129.9 Å²	129.9	80%	0.798	74%	0.744	S	S	*	*			trans	121.3	163.3	150.2	76.2	0	0	0	0	116
721	P	52.9	Low	30.9	Very low	108 Å²	108	131.6 Å²	131.6	70%	0.701	75%	0.75	S	S	*	*				-142.6	-169.7	-104.2	34.4	-8.3	0	0	0	117.1
722	Q	26.8	Very low	31.1	Very low	157 Å²	157	131 Å²	131	73%	0.734	76%	0.756	S	S	*	*			trans	141.1	138.1	132.5	-77.1	-163.9	13.4	0	0	118.6
723	Y	27.3	Very low	31.4	Very low	212 Å²	212	130 Å²	130	83%	0.831	77%	0.767	S	S	*	*			trans	40.4	160.8	159.2	-65.4	-80.4	0	0	0	122
724	A	24.1	Very low	31.2	Very low	86 Å²	86	125.5 Å²	125.5	71%	0.711	76%	0.764	S	S	*	*			cis	-167.9	173.7	-39	0	0	0	0	0	111.2
725	V	28.7	Very low	30.3	Very low	122 Å²	122	132.4 Å²	132.4	74%	0.739	78%	0.778	S	S	*	*			trans	-95.3	163.5	-172.2	-138	0	0	0	0	113.1
726	P	38.9	Very low	31	Very low	125 Å²	125	130.4 Å²	130.4	81%	0.812	78%	0.779	S	S	*	*				-149.3	177.1	89	39.8	-20.8	0	0	0	118.5
727	F	27.7	Very low	31.1	Very low	165 Å²	165	127 Å²	127	72%	0.724	77%	0.767	S	S	*	*			trans	-67.2	175.2	178.7	-84.7	-106.7	0	0	0	114.8	L729	F727-L729 HydrophobicContact CD1-CD1 3.87Å; F727-L729 HydrophobicContact CD1-CG 4.18Å; F727-L729 HydrophobicContact CE1-CD1 4.23Å
728	T	26.7	Very low	30.8	Very low	138 Å²	138	130 Å²	130	85%	0.847	77%	0.77	S	S	*	*				-161	-165.8	55.3	54.5	0	0	0	0	114.7
729	L	30.5	Very low	30.6	Very low	112 Å²	112	128.7 Å²	128.7	59%	0.586	76%	0.761	S	S	*	*				-172.9	132.7	-77.1	-138.8	178	0	0	0	111.8	F727 C731	F727-L729 HydrophobicContact CD1-CD1 3.87Å; F727-L729 HydrophobicContact CD1-CG 4.18Å; F727-L729 HydrophobicContact CE1-CD1 4.23Å; L729-C731 HydrophobicContact CD2-CB 4.17Å
730	S	24.5	Very low	30.3	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	77%	0.765	S	S	*	*			trans	179.3	130.8	156.5	-78.1	0	0	0	0	109.2
731	C	29.9	Very low	30.2	Very low	110 Å²	110	132.1 Å²	132.1	74%	0.743	77%	0.765	S	S	*	*			cis	71.4	143.1	7.1	-63.9	0	0	0	0	116.7	L729	L729-C731 HydrophobicContact CD2-CB 4.17Å
732	A	33.1	Very low	28.9	Very low	97 Å²	97	133.9 Å²	133.9	80%	0.802	77%	0.774	S	S	*	*			cis	-163	-172.3	-16.1	0	0	0	0	0	107.4
733	A	32.8	Very low	28.8	Very low	105 Å²	105	131 Å²	131	87%	0.868	78%	0.777	S	S	*	*			cis	-157.7	-171.6	5	0	0	0	0	0	107.4
734	G	26.5	Very low	28.8	Very low	67 Å²	67	125.3 Å²	125.3	69%	0.691	77%	0.774	S	S	*	*			cis	142.5	165.2	-5.7	0	0	0	0	0	113.9
735	R	29.9	Very low	28.7	Very low	236 Å²	236	127.2 Å²	127.2	89%	0.891	78%	0.776	S	S	*	*			trans	64	175.9	163.1	-78.9	-175.3	177.7	-118.3	-2.2	118.1
736	P	42.8	Very low	28.5	Very low	123 Å²	123	128.5 Å²	128.5	80%	0.799	78%	0.778	S	S	*	*			cis	-117.5	-170.2	-4.4	22.3	1.8	0	0	0	112.8
737	A	31	Very low	27.9	Very low	81 Å²	81	131.1 Å²	131.1	67%	0.669	78%	0.78	S	S	*	*			cis	-159.3	170.4	-28.3	0	0	0	0	0	105.5
738	L	25.1	Very low	27.7	Very low	153 Å²	153	127 Å²	127	80%	0.801	78%	0.777	S	S	*	*				-180	129.5	53.6	-171.7	74.8	0	0	0	104.5
739	V	25.1	Very low	27.9	Very low	113 Å²	113	131.7 Å²	131.7	69%	0.685	78%	0.779	S	S	*	*				78.2	100.2	61.3	179.9	0	0	0	0	115.6
740	E	25.6	Very low	28	Very low	179 Å²	179	132 Å²	132	84%	0.836	79%	0.788	S	S	*	*			trans	165.9	134.7	138.6	-92.1	-175.1	158.5	0	0	107.3
741	Q	24.4	Very low	28.1	Very low	171 Å²	171	129.6 Å²	129.6	80%	0.799	78%	0.781	S	S	*	*			cis	90.4	99	23.5	-166.9	176.9	3.2	0	0	115.5
742	T	26.3	Very low	27.8	Very low	145 Å²	145	127.5 Å²	127.5	89%	0.89	78%	0.778	S	S	*	*			trans	-177.5	158	135.9	-77.6	0	0	0	0	109.3
743	A	23.7	Very low	27.6	Very low	96 Å²	96	128.8 Å²	128.8	79%	0.793	78%	0.776	S	S	*	*			trans	-110.9	154.9	-168.9	0	0	0	0	0	114.4
744	A	27	Very low	27.3	Very low	93 Å²	93	131 Å²	131	77%	0.769	77%	0.769	S	S	*	*			trans	-156.6	100.7	159.9	0	0	0	0	0	113.3
745	V	22.8	Very low	27.2	Very low	125 Å²	125	134.6 Å²	134.6	76%	0.758	77%	0.767	S	S	*	*				53.6	107.4	114.1	173.2	0	0	0	0	119.9
746	L	24.6	Very low	27	Very low	149 Å²	149	129.6 Å²	129.6	78%	0.78	76%	0.757	S	S	*	*			trans	58.3	169.5	131.1	-50.7	179.2	0	0	0	119.6
747	Q	25.8	Very low	26.1	Very low	180 Å²	180	130.9 Å²	130.9	84%	0.841	76%	0.756	S	S	*	*			cis	-133	173.7	4.1	-96.4	-158.9	-1.4	0	0	113.3
748	A	22.9	Very low	26.1	Very low	80 Å²	80	134.6 Å²	134.6	66%	0.661	76%	0.764	S	S	*	*			trans	-72.5	-179.8	-171.9	0	0	0	0	0	118.6
749	W	31.9	Very low	26.3	Very low	235 Å²	235	133 Å²	133	89%	0.89	76%	0.762	S	S	*	*			trans	-7.3	144.3	133.4	-65	86	0	0	0	116.1
750	P	33.3	Very low	26.4	Very low	120 Å²	120	132.3 Å²	132.3	78%	0.779	76%	0.763	S	S	*	*			cis	-122.9	177.2	48.3	39.7	-25.4	0	0	0	113
751	G	24.6	Very low	26.5	Very low	64 Å²	64	129.6 Å²	129.6	66%	0.66	76%	0.759	S	S	*	*			cis	77.6	130	35.9	0	0	0	0	0	109.5
752	G	25.1	Very low	26.5	Very low	66 Å²	66	131.5 Å²	131.5	68%	0.68	76%	0.759	S	S	*	*			cis	-177.1	-136.7	3.7	0	0	0	0	0	107
753	T	27.7	Very low	26.5	Very low	124 Å²	124	130.5 Å²	130.5	76%	0.761	74%	0.744	S	S	*	*			trans	70.9	102.5	168.4	-44.3	0	0	0	0	112
754	Q	27	Very low	26.7	Very low	152 Å²	152	135.2 Å²	135.2	71%	0.71	75%	0.75	S	S	*	*				58.7	135.7	88.1	-62.4	178.5	31.6	0	0	112.5
755	Q	24.4	Very low	26.8	Very low	141 Å²	141	137.9 Å²	137.9	66%	0.659	75%	0.75	S	S	*	*			cis	-170	-179.9	13.1	-128.2	171.4	27.9	0	0	111
756	I	25.7	Very low	27.6	Very low	131 Å²	131	138.1 Å²	138.1	67%	0.672	76%	0.755	S	S	*	*			trans	85.2	142.3	139	-88.6	167.6	0	0	0	122
757	L	24.3	Very low	27.7	Very low	151 Å²	151	133.4 Å²	133.4	79%	0.791	74%	0.741	S	S	*	*			trans	60.5	108.7	163.6	-101.9	66.4	0	0	0	122
758	L	30	Very low	27.7	Very low	159 Å²	159	130 Å²	130	83%	0.832	73%	0.733	S	S	*	*			trans	-60.2	151.1	134.1	-71.5	158.7	0	0	0	109.4
759	P	30.1	Very low	27.9	Very low	118 Å²	118	128.5 Å²	128.5	77%	0.766	72%	0.72	S	S	*	*				-145.7	159	92	38.6	-24.1	0	0	0	115.4
760	S	26.9	Very low	27.6	Very low	100 Å²	100	123 Å²	123	70%	0.699	71%	0.708	S	S	*	*			trans	-124.5	114.5	161.6	56.9	0	0	0	0	109.3
761	T	27.7	Very low	27.3	Very low	121 Å²	121	124 Å²	124	74%	0.742	70%	0.701	S	S	*	*			trans	174.1	145.8	150.9	35	0	0	0	0	114
762	W	25.8	Very low	27.5	Very low	211 Å²	211	127.2 Å²	127.2	80%	0.799	70%	0.704	S	S	*	*			trans	72.7	123.9	143.5	-76.4	40.7	0	0	0	117.4
763	Q	26.3	Very low	27.7	Very low	125 Å²	125	128.9 Å²	128.9	58%	0.584	71%	0.705	S	S	*	*				101	143.9	65	-85.3	-164.4	16.3	0	0	110.9
764	Q	25.9	Very low	27.6	Very low	195 Å²	195	129.2 Å²	129.2	91%	0.911	71%	0.707	S	S	*	*				-166.7	159.5	117.9	-107	174.4	5.3	0	0	115.4
765	L	30	Very low	27.6	Very low	148 Å²	148	131 Å²	131	78%	0.775	72%	0.715	S	S	*	*			trans	-103.8	171.2	-178.3	-104.3	155.5	0	0	0	110.5
766	P	39	Very low	28.3	Very low	131 Å²	131	129 Å²	129	85%	0.851	71%	0.714	S	S	*	*				-160	169.1	96.2	39.2	-18.1	0	0	0	119.2
767	G	27.1	Very low	28.3	Very low	49 Å²	49	128.9 Å²	128.9	51%	0.505	72%	0.72	S	S	.	*			trans	153.3	141	164.2	0	0	0	0	0	117.5	Q788	G767-Q788 PolarHBondContact O-NE2 3.19Å
768	V	27.1	Very low	28.5	Very low	110 Å²	110	126.1 Å²	126.1	67%	0.667	72%	0.719	S	S	*	*			trans	-151.5	156	-159.3	-179.4	0	0	0	0	117.9	Q788 Q789	V768-Q788 VanDerWaalsContact CA-NE2 3.28Å; V768-Q788 PolarHBondContact O-OE1 3.47Å; V768-Q789 VanDerWaalsContact CA-OE1 3.31Å
769	A	26.5	Very low	28.6	Very low	47 Å²	47	127.1 Å²	127.1	39%	0.388	72%	0.721	S	S	.	*			trans	92.3	141.7	163.9	0	0	0	0	0	121.6	Q788	A769-Q788 CarbonylContact C-O 3.46Å; A769-Q788 WeakPolarHBondContact CA-O 3.11Å; A769-Q788 PolarHBondContact N-O 2.68Å; A769-Q788 PolarHBondContact O-N 2.79Å; A769-Q788 PolarHBondContact O-OE1 3.1Å
770	L	25.1	Very low	28.6	Very low	121 Å²	121	128.9 Å²	128.9	63%	0.634	72%	0.723	S	S	*	*			cis	-115.8	-77.1	-8.2	-65.4	172.4	0	0	0	122.5	G787 Q788 Q789	L770-G787 CarbonylContact C-O 3.58Å; L770-G787 VanDerWaalsContact N-C 3.3Å; L770-Q788 CarbonylContact C-O 3.46Å; L770-Q788 WeakPolarHBondContact CA-O 3.2Å; L770-Q788 PolarHBondContact N-O 3.07Å; L770-Q788 CarbonylContact O-C 3.53Å; L770-Q789 PolarHBondContact O-N 3.17Å
771	H	27.8	Very low	29.6	Very low	139 Å²	139	129 Å²	129	64%	0.644	72%	0.721	S	S	*	*			trans	-147.5	153.1	-151.3	-108	-111.5	0	0	0	122.9	G787	H771-G787 PolarHBondContact N-O 2.99Å
772	N	28.9	Very low	29.7	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	73%	0.729	S	S	*	*			trans	58.3	115.1	141.4	-79.9	-0.9	0	0	0	129.3
773	S	28.7	Very low	29.9	Very low	102 Å²	102	127.6 Å²	127.6	71%	0.713	73%	0.734	S	S	*	*				64	145.2	120.2	73.8	0	0	0	0	127.8
774	V	25.5	Very low	30	Very low	131 Å²	131	131.2 Å²	131.2	79%	0.794	75%	0.753	S	S	*	*			trans	104	97.3	152.4	-170.7	0	0	0	0	120.9
775	Q	27.8	Very low	30.2	Very low	189 Å²	189	125.8 Å²	125.8	88%	0.883	75%	0.75	S	S	*	*			trans	51.8	175	134.2	-88.3	-153.4	17.2	0	0	123.2
776	P	37.3	Very low	30.1	Very low	98 Å²	98	125.1 Å²	125.1	64%	0.636	76%	0.757	S	S	*	*			trans	-110	172.5	-155.8	41.8	-36.3	0	0	0	117.2
777	T	26.1	Very low	29.7	Very low	130 Å²	130	120.7 Å²	120.7	80%	0.798	74%	0.735	S	S	*	*			trans	103.1	130	155.7	-39.9	0	0	0	0	117.2
778	A	29.9	Very low	29.7	Very low	93 Å²	93	122.9 Å²	122.9	77%	0.769	73%	0.732	S	S	*	*			trans	64.8	151.9	162.5	0	0	0	0	0	120.3
779	M	30.8	Very low	29.9	Very low	180 Å²	180	122.4 Å²	122.4	89%	0.887	72%	0.723	S	S	*	*			trans	-73.9	153.8	151.8	-61.2	177.3	159.2	0	0	107.5
780	I	30.3	Very low	30	Very low	154 Å²	154	127.1 Å²	127.1	79%	0.79	74%	0.741	S	S	*	*			cis	-159.8	154.6	42.9	-64.7	168.7	0	0	0	106.2
781	P	47.4	Very low	30.3	Very low	104 Å²	104	125 Å²	125	68%	0.675	74%	0.741	S	S	*	*			cis	-132	172.6	-12.6	36	-17.2	0	0	0	117
782	E	30.3	Very low	30.5	Very low	193 Å²	193	125 Å²	125	90%	0.902	75%	0.746	S	S	*	*			trans	60.9	158.9	144	-75.6	-170	129.2	0	0	126.2
783	A	29.9	Very low	30.4	Very low	109 Å²	109	127.8 Å²	127.8	90%	0.901	75%	0.746	S	S	*	*			trans	90.4	165.2	169.2	0	0	0	0	0	120.4
784	M	29.3	Very low	30.5	Very low	201 Å²	201	131.9 Å²	131.9	99%	0.99	75%	0.746	S	S	*	*			trans	-115.3	156.3	-156.1	-47	176.9	-170.7	0	0	116
785	G	28.5	Very low	30.6	Very low	81 Å²	81	132.3 Å²	132.3	84%	0.835	74%	0.744	S	S	*	*			trans	148	138	150	0	0	0	0	0	120
786	S	28.1	Very low	30.8	Very low	133 Å²	133	126.5 Å²	126.5	93%	0.93	73%	0.728	S	S	*	*			trans	-70.1	164.7	174.1	46.4	0	0	0	0	115.9
787	G	30.8	Very low	30.5	Very low	38 Å²	38	130.5 Å²	130.5	39%	0.392	74%	0.738	S	S	.	*			cis	-173.2	-148.1	19.8	0	0	0	0	0	116.3	L770 H771	L770-G787 CarbonylContact C-O 3.58Å; L770-G787 VanDerWaalsContact N-C 3.3Å; H771-G787 PolarHBondContact N-O 2.99Å
788	Q	27.7	Very low	30.7	Very low	95 Å²	95	128.4 Å²	128.4	44%	0.444	73%	0.729	S	S	.	*			trans	-98.8	156.1	-158.4	-35.7	140.5	-118.4	0	0	123.1	G767 V768 A769 L770	G767-Q788 PolarHBondContact O-NE2 3.19Å; V768-Q788 VanDerWaalsContact CA-NE2 3.28Å; V768-Q788 PolarHBondContact O-OE1 3.47Å; A769-Q788 CarbonylContact C-O 3.46Å; A769-Q788 WeakPolarHBondContact CA-O 3.11Å; A769-Q788 PolarHBondContact N-O 2.68Å; A769-Q788 PolarHBondContact O-N 2.79Å; A769-Q788 PolarHBondContact O-OE1 3.1Å; L770-Q788 CarbonylContact C-O 3.46Å; L770-Q788 WeakPolarHBondContact CA-O 3.2Å; L770-Q788 PolarHBondContact N-O 3.07Å; L770-Q788 CarbonylContact O-C 3.53Å
789	Q	30.4	Very low	30.8	Very low	100 Å²	100	132.7 Å²	132.7	47%	0.467	73%	0.733	S	S	.	*			trans	73.8	156.7	145.1	-86.2	-178.4	-3.5	0	0	122.8	V768 L770	V768-Q789 VanDerWaalsContact CA-OE1 3.31Å; L770-Q789 PolarHBondContact O-N 3.17Å
790	L	29.5	Very low	30.5	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	72%	0.721	S	S	*	*			cis	-169.6	159.3	-6.4	-167.3	80.8	0	0	0	112.3
791	A	31.6	Very low	30.5	Very low	78 Å²	78	126.3 Å²	126.3	65%	0.645	72%	0.719	S	S	*	*			trans	70.7	157.9	150.9	0	0	0	0	0	121.5
792	D	31.1	Very low	29.6	Very low	139 Å²	139	128.1 Å²	128.1	74%	0.743	72%	0.718	S	S	*	*			cis	-165.4	162.3	-13.3	-125.3	-19.9	0	0	0	115.8
793	W	27.5	Very low	29.5	Very low	189 Å²	189	129.2 Å²	129.2	72%	0.716	72%	0.715	S	S	*	*			trans	79.3	125.3	147	-80.4	30	0	0	0	128.8
794	R	31.7	Very low	29.5	Very low	188 Å²	188	128 Å²	128	71%	0.709	70%	0.7	S	S	*	*				104.4	146.4	124	-90.4	-169	-173.7	-131.5	4.2	127.5
795	N	27.6	Very low	29.6	Very low	141 Å²	141	124.2 Å²	124.2	75%	0.754	69%	0.689	S	S	*	*			trans	77.5	155.7	157.1	-61.4	-11.7	0	0	0	121.2
796	A	31.8	Very low	29.6	Very low	66 Å²	66	127.9 Å²	127.9	55%	0.545	69%	0.687	S	S	.	*			cis	-174.9	163.8	-30.6	0	0	0	0	0	113.9
797	H	30	Very low	29.5	Very low	183 Å²	183	127.9 Å²	127.9	85%	0.847	67%	0.674	S	S	*	*			trans	73.9	158.5	162	-52.7	-67.9	0	0	0	121.7
798	S	29.9	Very low	29.4	Very low	85 Å²	85	134 Å²	134	59%	0.594	69%	0.693	S	S	*	*			cis	-172.2	162.8	-38.9	55.6	0	0	0	0	116
799	H	32.3	Very low	29.2	Very low	184 Å²	184	137.4 Å²	137.4	85%	0.852	71%	0.709	S	S	*	*			trans	87.8	140.5	156.7	-59.4	-63	0	0	0	126.3
800	G	25.3	Very low	29.3	Very low	63 Å²	63	138.2 Å²	138.2	65%	0.649	72%	0.723	S	S	*	*			trans	108	110.9	157.6	0	0	0	0	0	116.4
801	N	29.1	Very low	29.2	Very low	137 Å²	137	136.2 Å²	136.2	73%	0.733	72%	0.721	S	S	*	*			cis	79.6	132.8	30.9	-54.1	80.5	0	0	0	114.5
802	Q	30	Very low	29.1	Very low	142 Å²	142	138.4 Å²	138.4	66%	0.664	72%	0.721	S	S	*	*			cis	-162.3	163.1	-11.4	-116.4	163	-67.8	0	0	109.1
803	Y	27.9	Very low	28.9	Very low	215 Å²	215	137 Å²	137	84%	0.843	71%	0.713	S	S	*	*				-177.8	137.4	86.8	-92	-97.3	0	0	0	107.1
804	S	30	Very low	29	Very low	83 Å²	83	131.3 Å²	131.3	58%	0.58	70%	0.699	S	S	*	*				85.1	137.4	58.5	-58.7	0	0	0	0	114.2
805	T	29.9	Very low	28.7	Very low	123 Å²	123	127.6 Å²	127.6	76%	0.755	69%	0.693	S	S	*	*			cis	-138.7	-149	2	-16.5	0	0	0	0	109.5
806	I	28.7	Very low	28.8	Very low	157 Å²	157	127.5 Å²	127.5	81%	0.805	69%	0.688	S	S	*	*			cis	-141.2	-146.4	10.9	-159.4	158.5	0	0	0	112
807	M	27.2	Very low	28.5	Very low	133 Å²	133	130 Å²	130	66%	0.655	70%	0.696	S	S	*	*			trans	-149.5	160.4	-149.6	-71.4	155.8	54.3	0	0	115.8
808	Q	27.4	Very low	28.3	Very low	167 Å²	167	126.8 Å²	126.8	78%	0.78	69%	0.69	S	S	*	*			trans	73.2	128.9	159.4	-69	163.1	-0.1	0	0	118.9
809	Q	23.6	Very low	28	Very low	167 Å²	167	130.4 Å²	130.4	78%	0.78	70%	0.701	S	S	*	*			cis	82.3	148.9	39.5	-66.1	-85.7	-10	0	0	113.4
810	P	33.7	Very low	27.7	Very low	117 Å²	117	125.2 Å²	125.2	76%	0.76	69%	0.69	S	S	*	*			cis	-131.7	-169.2	15.4	43.6	-27.1	0	0	0	116.6
811	S	28.1	Very low	27.7	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	70%	0.698	S	S	*	*			trans	-118.7	165	169.9	-57.7	0	0	0	0	111.4
812	L	28.4	Very low	27.5	Very low	124 Å²	124	126.4 Å²	126.4	65%	0.649	70%	0.7	S	S	*	*			trans	161.5	121.2	132.3	-86.1	173.1	0	0	0	113.4
813	L	27.6	Very low	27.4	Very low	111 Å²	111	127.4 Å²	127.4	58%	0.581	70%	0.704	S	S	*	*			trans	49.5	167.8	139.9	-51	179.9	0	0	0	121.4	T711	T711-L813 WeakPolarHBondContact O-CD1 3.42Å
814	T	28.7	Very low	27.6	Very low	69 Å²	69	122.2 Å²	122.2	42%	0.423	70%	0.697	S	S	.	*			cis	-150.7	156.6	-3.6	-17.2	0	0	0	0	109.4
815	N	26.7	Very low	27.3	Very low	109 Å²	109	124.7 Å²	124.7	58%	0.583	70%	0.703	S	S	*	*				171.3	144.8	117	-92.4	-31.2	0	0	0	115.5
816	H	27.7	Very low	27.1	Very low	140 Å²	140	125.7 Å²	125.7	65%	0.648	70%	0.704	S	S	*	*			trans	51.6	130.5	165.3	-56.6	-60	0	0	0	119.9
817	V	26.7	Very low	27	Very low	118 Å²	118	123.7 Å²	123.7	72%	0.715	70%	0.698	S	S	*	*			cis	81.5	97.9	26.2	-172.6	0	0	0	0	114.5
818	T	25.9	Very low	26.9	Very low	116 Å²	116	120.8 Å²	120.8	71%	0.712	70%	0.703	S	S	*	*			trans	28.6	141.7	135.4	11	0	0	0	0	120.2	A820	T818-A820 HydrophobicContact CG2-CB 4.26Å
819	L	24.1	Very low	26.9	Very low	160 Å²	160	119.2 Å²	119.2	84%	0.838	70%	0.704	S	S	*	*				-161.8	129.9	66.9	-149.7	66.5	0	0	0	107.9
820	A	25	Very low	26.9	Very low	75 Å²	75	115 Å²	115	62%	0.62	70%	0.698	S	S	*	*				77.6	96.1	51.1	0	0	0	0	0	115.8	T818	T818-A820 HydrophobicContact CG2-CB 4.26Å
821	T	25	Very low	26.6	Very low	134 Å²	134	118 Å²	118	82%	0.822	70%	0.702	S	S	*	*			trans	-135.4	126.5	150.8	44.9	0	0	0	0	106
822	A	25.7	Very low	26.4	Very low	92 Å²	92	119.1 Å²	119.1	76%	0.76	70%	0.704	S	S	*	*			cis	64	131.4	47.2	0	0	0	0	0	111.8
823	Q	27.7	Very low	26.1	Very low	162 Å²	162	119.3 Å²	119.3	76%	0.757	71%	0.71	S	S	*	*			cis	-170.6	161.8	-8.3	-123.1	-97.3	-18.5	0	0	105.4
824	P	31.9	Very low	25.9	Very low	107 Å²	107	124 Å²	124	70%	0.695	72%	0.72	S	S	*	*				-153.4	138.5	112.4	31.4	-11.2	0	0	0	117.9
825	L	24.8	Very low	25.6	Very low	134 Å²	134	127.9 Å²	127.9	70%	0.702	73%	0.733	S	S	*	*			trans	71.7	116.9	133.2	-62.9	171.6	0	0	0	118.3
826	N	24.4	Very low	25.5	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	74%	0.737	S	S	*	*				81.3	141.1	78.4	-101	-4.5	0	0	0	113.2
827	V	26.8	Very low	25.3	Very low	114 Å²	114	130.4 Å²	130.4	69%	0.691	74%	0.741	S	S	*	*			cis	-136.2	145.4	14	178.7	0	0	0	0	108	V829	V827-V829 HydrophobicContact CG1-CG2 4.07Å
828	G	25	Very low	25.2	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	74%	0.741	S	S	*	*				66.5	152	83.9	0	0	0	0	0	113.8
829	V	26.7	Very low	25.1	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	74%	0.739	S	S	*	*			cis	-153.4	161.6	23.3	171.9	0	0	0	0	110.6	V827	V827-V829 HydrophobicContact CG1-CG2 4.07Å
830	A	25.4	Very low	25.1	Very low	79 Å²	79	126.6 Å²	126.6	65%	0.653	74%	0.738	S	S	*	*			trans	-138	179.1	165.7	0	0	0	0	0	111.7
831	H	25.8	Very low	25.1	Very low	180 Å²	180	130.8 Å²	130.8	83%	0.833	75%	0.749	S	S	*	*			trans	81.4	141.3	-169.3	-58.2	-91.4	0	0	0	115.4
832	V	23.9	Very low	25.6	Very low	126 Å²	126	129 Å²	129	76%	0.764	74%	0.74	S	S	*	*			cis	117.5	128.6	-2.3	174.5	0	0	0	0	115.1
833	V	22.5	Very low	25.6	Very low	127 Å²	127	128.3 Å²	128.3	77%	0.77	73%	0.73	S	S	*	*			trans	74.9	139.9	167.7	156.5	0	0	0	0	115.7
834	R	22.7	Very low	25.6	Very low	210 Å²	210	128.5 Å²	128.5	79%	0.792	73%	0.728	S	S	*	*			cis	-151	170.8	15.2	-149.5	170	-178	146.4	-0.5	113.7
835	Q	23.4	Very low	25.4	Very low	150 Å²	150	129.8 Å²	129.8	70%	0.701	72%	0.723	S	S	*	*			trans	72.3	149.7	155.5	-96.2	159.8	-71.1	0	0	118
836	Q	24.2	Very low	25.6	Very low	143 Å²	143	129.9 Å²	129.9	67%	0.668	72%	0.724	S	S	*	*			cis	-145.8	179.5	-0.4	-165.1	150.9	-22	0	0	112.5
837	Q	23.3	Very low	25.8	Very low	159 Å²	159	130.2 Å²	130.2	74%	0.743	72%	0.719	S	S	*	*			trans	-57.3	167.8	-175.7	-52.7	129.1	-41.6	0	0	114.2
838	S	24	Very low	25.7	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	72%	0.717	S	S	*	*			cis	-166.9	166.5	29.6	60.4	0	0	0	0	116.6
839	S	24.2	Very low	25.8	Very low	96 Å²	96	133 Å²	133	67%	0.671	72%	0.716	S	S	*	*			trans	63.6	122.9	138.1	61.6	0	0	0	0	125.9
840	S	25.7	Very low	26.1	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	71%	0.709	S	S	*	*			trans	83.9	147.1	130.4	63.6	0	0	0	0	124.8
841	L	23.9	Very low	26.8	Very low	163 Å²	163	132.6 Å²	132.6	85%	0.853	72%	0.716	S	S	*	*			trans	-89.7	-166.5	167	-43.7	94.2	0	0	0	110.1
842	P	34.9	Very low	27	Very low	96 Å²	96	130 Å²	130	62%	0.623	71%	0.713	S	S	*	*			cis	-128.5	-117.3	-13.1	39.9	-20.2	0	0	0	113.4	K1203	P842-K1203 PolarHBondContact O-NZ 2.66Å
843	S	25.7	Very low	27.3	Very low	79 Å²	79	129 Å²	129	55%	0.552	71%	0.712	S	S	*	*			trans	52.7	156.4	158.2	43.3	0	0	0	0	123	K1203	S843-K1203 WeakPolarHBondContact O-CD 3.01Å; S843-K1203 PolarHBondContact O-NZ 3.3Å
844	K	27.3	Very low	27.7	Very low	166 Å²	166	127.1 Å²	127.1	72%	0.722	70%	0.704	S	S	*	*			cis	-168.3	175	-36	-137.3	-178.5	-176.6	-179.2	0	110.6	T1202	K844-T1202 VanDerWaalsContact O-O 3.1Å; K844-T1202 PolarHBondContact O-OG1 3.33Å
845	K	28.2	Very low	27.9	Very low	133 Å²	133	126.1 Å²	126.1	58%	0.578	71%	0.705	S	S	*	*			trans	-88.4	162.9	-173.1	-137.1	170.4	-175.7	-177.2	0	116	T1202 K1203	K845-T1202 WeakPolarHBondContact CA-O 3.43Å; K845-K1203 WeakPolarHBondContact CA-O 3.41Å; K845-K1203 WeakPolarHBondContact CB-O 3.43Å; K845-K1203 WeakPolarHBondContact CG-O 3.06Å; K845-K1203 PolarHBondContact N-O 2.74Å
846	N	29.5	Very low	28.2	Very low	136 Å²	136	124 Å²	124	73%	0.727	71%	0.707	S	S	*	*			trans	74.5	160.5	162.7	-69.5	-8.5	0	0	0	117.1
847	K	27.7	Very low	28.3	Very low	152 Å²	152	122 Å²	122	66%	0.661	71%	0.709	S	S	*	*			cis	-156.4	176.1	14.2	-141.2	-171.9	-171.1	-144.2	0	113.2
848	Q	25.7	Very low	28.5	Very low	142 Å²	142	121.9 Å²	121.9	66%	0.664	71%	0.713	S	S	*	*			trans	-5.9	159.9	144.7	-75.1	169.9	-26.4	0	0	120.2
849	S	26.8	Very low	28.6	Very low	104 Å²	104	123.6 Å²	123.6	73%	0.727	71%	0.714	S	S	*	*			cis	179.9	161.4	-3.7	48.8	0	0	0	0	112.7
850	A	33.1	Very low	28.6	Very low	79 Å²	79	124.9 Å²	124.9	65%	0.653	72%	0.717	S	S	*	*			trans	31.4	148.9	142.3	0	0	0	0	0	123.3	V852	A850-V852 HydrophobicContact CB-CG2 4.07Å
851	P	41.1	Very low	28.7	Very low	125 Å²	125	126.8 Å²	126.8	81%	0.812	72%	0.718	S	S	*	*				-142.2	154.4	91.1	36	-19.7	0	0	0	115
852	V	29.4	Very low	29.7	Very low	126 Å²	126	124 Å²	124	76%	0.764	71%	0.709	S	S	*	*			cis	83.1	124.9	29.2	175.8	0	0	0	0	112.4	A850	A850-V852 HydrophobicContact CB-CG2 4.07Å
853	S	29.8	Very low	29.4	Very low	106 Å²	106	124.1 Å²	124.1	74%	0.741	71%	0.712	S	S	*	*			cis	-160.5	-161.2	-1.5	53.5	0	0	0	0	109.2
854	S	30.2	Very low	29.5	Very low	87 Å²	87	128.4 Å²	128.4	61%	0.608	72%	0.724	S	S	*	*			cis	-169.1	179.9	14	48.8	0	0	0	0	111.8
855	K	28.6	Very low	29.4	Very low	188 Å²	188	125.9 Å²	125.9	82%	0.817	72%	0.722	S	S	*	*			trans	84.1	127.5	163	-56.8	165.2	-173.2	-178.9	0	117.9
856	S	28.8	Very low	29.2	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	73%	0.734	S	S	*	*			cis	94.3	138.3	20	79.8	0	0	0	0	115.4
857	S	27.2	Very low	29	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	74%	0.735	S	S	*	*			cis	-177.4	-173.5	-4.8	43.6	0	0	0	0	110.6
858	L	27.9	Very low	29.1	Very low	158 Å²	158	128 Å²	128	83%	0.827	74%	0.74	S	S	*	*			trans	75.4	150.5	170.1	-70.4	162.6	0	0	0	116.1
859	D	24.6	Very low	29.2	Very low	138 Å²	138	127.4 Å²	127.4	74%	0.738	75%	0.746	S	S	*	*			cis	-171.2	-173.3	-10.7	-171.1	15.9	0	0	0	110.9
860	V	24.4	Very low	29.2	Very low	123 Å²	123	125.6 Å²	125.6	75%	0.745	74%	0.743	S	S	*	*			trans	95.6	137.3	156.1	-172.4	0	0	0	0	120.7
861	L	28.3	Very low	28.9	Very low	156 Å²	156	127.6 Å²	127.6	82%	0.817	75%	0.752	S	S	*	*			trans	-120	153.9	171.8	-153.9	93.4	0	0	0	108.7
862	P	45.1	Very low	28.4	Very low	104 Å²	104	127.2 Å²	127.2	68%	0.675	75%	0.752	S	S	*	*				-163.6	170.1	93.9	42.3	-22.1	0	0	0	118.8
863	S	28.3	Very low	29.3	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	75%	0.751	S	S	*	*			trans	57.1	160.5	142.6	-70.1	0	0	0	0	122.9
864	Q	27.8	Very low	29.6	Very low	170 Å²	170	128.7 Å²	128.7	79%	0.794	75%	0.753	S	S	*	*			cis	-164.5	151.4	-24.5	-107.6	-178.8	-0.9	0	0	110.9
865	V	25	Very low	29.6	Very low	112 Å²	112	134.1 Å²	134.1	68%	0.679	76%	0.76	S	S	*	*			trans	38.1	122.1	143.8	-169.8	0	0	0	0	121.8
866	Y	24.9	Very low	29.5	Very low	215 Å²	215	130.1 Å²	130.1	84%	0.843	75%	0.752	S	S	*	*				-172.2	179.9	114	-115.7	-79.8	0	0	0	114
867	S	25.3	Very low	29.4	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	75%	0.752	S	S	*	*			trans	-144.2	-161.4	-172.9	-166.7	0	0	0	0	111.2
868	L	29.5	Very low	29.5	Very low	145 Å²	145	130.9 Å²	130.9	76%	0.759	75%	0.752	S	S	*	*			trans	84.7	147.5	177.6	-47.9	170.2	0	0	0	114.9
869	V	28.3	Very low	29.7	Very low	130 Å²	130	128.5 Å²	128.5	79%	0.788	75%	0.748	S	S	*	*			cis	-158.9	152.8	-7.1	112.4	0	0	0	0	112.9
870	G	25.8	Very low	29.8	Very low	65 Å²	65	131.8 Å²	131.8	67%	0.67	75%	0.752	S	S	*	*			trans	79.7	150.6	149.8	0	0	0	0	0	119.1
871	S	26.7	Very low	30	Very low	121 Å²	121	132.2 Å²	132.2	85%	0.846	75%	0.75	S	S	*	*			cis	-157.7	159.9	-6.3	-76.4	0	0	0	0	111.2
872	S	30.3	Very low	29.9	Very low	117 Å²	117	129.2 Å²	129.2	82%	0.818	74%	0.743	S	S	*	*			trans	-149.4	160.4	172.1	-52.3	0	0	0	0	111.1
873	P	48.6	Very low	28.9	Very low	112 Å²	112	131.8 Å²	131.8	73%	0.727	75%	0.75	S	S	*	*			trans	-129.2	124.7	146.1	9.9	12.5	0	0	0	113.5
874	L	35.3	Very low	28.7	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	76%	0.755	S	S	*	*				81	142.1	100.8	-61.9	175.2	0	0	0	113.8
875	R	30.9	Very low	29.4	Very low	201 Å²	201	130.4 Å²	130.4	76%	0.758	75%	0.75	S	S	*	*			cis	-166.6	150.7	13.4	-138.9	-177.5	-167.5	-154.8	3.4	115.4
876	T	27.4	Very low	29.5	Very low	104 Å²	104	131.2 Å²	131.2	64%	0.638	76%	0.755	S	S	*	*			trans	60.4	148.2	141.8	42.3	0	0	0	0	123.1
877	T	26.4	Very low	29.6	Very low	119 Å²	119	128 Å²	128	73%	0.73	75%	0.748	S	S	*	*			cis	-168.9	147.2	-17.8	16	0	0	0	0	114.6
878	S	28	Very low	29.7	Very low	102 Å²	102	125.8 Å²	125.8	71%	0.713	73%	0.728	S	S	*	*			trans	46.1	139.7	139.4	70.1	0	0	0	0	126.4
879	S	32.6	Very low	29.5	Very low	108 Å²	108	124.4 Å²	124.4	76%	0.755	72%	0.717	S	S	*	*			trans	-98.3	169.2	163.9	46.9	0	0	0	0	114.2
880	Y	27.6	Very low	29.4	Very low	207 Å²	207	122.7 Å²	122.7	81%	0.812	70%	0.701	S	S	*	*			trans	-153.9	141.1	158.5	-89.5	-88.9	0	0	0	108.6
881	N	27.7	Very low	29.3	Very low	132 Å²	132	123.6 Å²	123.6	71%	0.706	69%	0.687	S	S	*	*				80.8	148.5	51.9	-88.9	-38.5	0	0	0	114.6
882	S	26.1	Very low	29.8	Very low	94 Å²	94	122.1 Å²	122.1	66%	0.657	68%	0.675	S	S	*	*			cis	-175.5	-173.5	-17.6	-115.5	0	0	0	0	111.3
883	L	24.8	Very low	29.5	Very low	158 Å²	158	124.3 Å²	124.3	83%	0.827	68%	0.676	S	S	*	*			trans	95.5	135.1	167.1	-51.5	164.1	0	0	0	117.7
884	V	24	Very low	28.3	Very low	130 Å²	130	126 Å²	126	79%	0.788	68%	0.677	S	S	*	*			cis	95.3	141.8	16.4	176.1	0	0	0	0	113.5
885	P	42.5	Very low	27.9	Very low	108 Å²	108	125.8 Å²	125.8	70%	0.701	68%	0.675	S	S	*	*			cis	-144.2	-175.1	17.1	36.4	-12.2	0	0	0	121.1
886	V	26.6	Very low	28	Very low	130 Å²	130	121.2 Å²	121.2	79%	0.788	67%	0.672	S	S	*	*			trans	74.2	148.6	137.6	149	0	0	0	0	122.9
887	Q	27.1	Very low	28	Very low	147 Å²	147	123.1 Å²	123.1	69%	0.687	68%	0.678	S	S	*	*			cis	-178.8	144.5	-26.1	-160.5	-168.9	-44.1	0	0	114.2
888	D	27.6	Very low	28.1	Very low	60 Å²	60	123.9 Å²	123.9	32%	0.321	68%	0.682	S	S	.	*			trans	55.9	167.7	150.2	-80.2	-16.9	0	0	0	122.8	Y118 K120	Y118-D888 PolarHBondContact OH-OD1 3.17Å; K120-D888 IonicContact NZ-OD1 3.41Å; K120-D888 PolarHBondContact NZ-OD1 3.14Å
889	Q	25	Very low	28.7	Very low	115 Å²	115	124.4 Å²	124.4	54%	0.537	68%	0.683	S	S	.	*			cis	-159.3	152.9	-6.4	-121.7	172	65.8	0	0	115.4	Y118	Y118-Q889 HydrophobicContact CE1-CG 4.45Å
890	H	26.9	Very low	28.4	Very low	95 Å²	95	124.9 Å²	124.9	44%	0.44	69%	0.687	S	S	.	*			trans	65	151.2	157.7	-67	118.9	0	0	0	124.9
891	Q	22.6	Very low	28.5	Very low	83 Å²	83	120.4 Å²	120.4	39%	0.388	68%	0.683	S	S	.	*			trans	-171.9	164.8	-170.3	173.3	-86.6	0.3	0	0	113	P117 Y118 Q119	P117-Q891 VanDerWaalsContact O-CB 3.31Å; P117-Q891 WeakPolarHBondContact O-CB 3.39Å; P117-Q891 WeakPolarHBondContact O-CG 3.44Å; Y118-Q891 VanDerWaalsContact C-CB 3.42Å; Y118-Q891 WeakPolarHBondContact O-CB 3.5Å; Y118-Q891 VanDerWaalsContact O-CG 3.24Å; Y118-Q891 WeakPolarHBondContact O-CG 3.29Å; Q119-Q891 HydrophobicContact CB-CB 3.91Å; Q119-Q891 HydrophobicContact CG-CB 4.14Å; Q119-Q891 WeakPolarHBondContact CG-O 3.48Å; Q119-Q891 PolarHBondContact NE2-O 3.4Å
892	P	37.9	Very low	28.5	Very low	90 Å²	90	119.9 Å²	119.9	58%	0.584	69%	0.687	S	S	*	*			trans	-139.4	178.7	177.4	44.5	-28.5	0	0	0	119
893	I	24.3	Very low	28.5	Very low	164 Å²	164	122 Å²	122	84%	0.841	70%	0.696	S	S	*	*			trans	84.1	155.8	159.4	-72.1	166.1	0	0	0	119.8
894	I	23.6	Very low	28.6	Very low	147 Å²	147	119 Å²	119	75%	0.754	69%	0.688	S	S	*	*			trans	-164.9	168.5	-162.3	-171	163.6	0	0	0	114.3
895	I	27.4	Very low	28.8	Very low	148 Å²	148	119 Å²	119	76%	0.759	69%	0.688	S	S	*	*			trans	67	152.5	173.1	46.3	172.2	0	0	0	121.1
896	P	31.4	Very low	28	Very low	104 Å²	104	118.4 Å²	118.4	68%	0.675	68%	0.678	S	S	*	*			cis	-130.9	164.8	-3.5	36.8	-18.8	0	0	0	118.2
897	D	27.7	Very low	28	Very low	144 Å²	144	117.8 Å²	117.8	77%	0.77	68%	0.675	S	S	*	*			trans	25.5	151.4	143.1	-50.9	-38.9	0	0	0	122.8
898	T	28.8	Very low	28	Very low	135 Å²	135	114.7 Å²	114.7	83%	0.828	66%	0.662	S	S	*	*			cis	-164.6	158	45.5	-35.1	0	0	0	0	111.8
899	P	39.8	Very low	27.8	Very low	113 Å²	113	122.5 Å²	122.5	73%	0.734	69%	0.687	S	S	*	*			trans	-121.1	165.4	-165.7	41.8	-32	0	0	0	118
900	S	26.9	Very low	27.8	Very low	118 Å²	118	120.3 Å²	120.3	83%	0.825	68%	0.684	S	S	*	*			trans	-178.4	162	156.3	-85.5	0	0	0	0	112.2
901	P	30.5	Very low	27.8	Very low	113 Å²	113	121 Å²	121	73%	0.734	69%	0.691	S	S	*	*			cis	-130.8	159.7	-36.2	39	-25	0	0	0	113.4
902	P	28.1	Very low	28.1	Very low	121 Å²	121	123.7 Å²	123.7	79%	0.786	71%	0.713	S	S	*	*			trans	-90.5	150.4	-179.9	34.9	-34.6	0	0	0	114.6
903	V	25.8	Very low	27.8	Very low	139 Å²	139	126.6 Å²	126.6	84%	0.842	72%	0.724	S	S	*	*			trans	-109.5	118.5	170.3	177.3	0	0	0	0	110.2
904	S	26	Very low	28.3	Very low	94 Å²	94	128 Å²	128	66%	0.657	73%	0.727	S	S	*	*			trans	-96.5	119.8	-177.2	-56	0	0	0	0	112.9
905	V	29.1	Very low	28.6	Very low	131 Å²	131	130.9 Å²	130.9	79%	0.794	74%	0.737	S	S	*	*			trans	-91.5	117	164.9	178	0	0	0	0	108.6
906	I	24.9	Very low	28.9	Very low	95 Å²	95	132.1 Å²	132.1	49%	0.487	74%	0.74	S	S	.	*			trans	-97.7	96.3	-177.6	-55.1	179	0	0	0	109.7	I908	I906-I908 HydrophobicContact CG2-CG1 3.89Å; I906-I908 PolarHBondContact O-N 3.31Å
907	T	27.4	Very low	28.9	Very low	118 Å²	118	134.3 Å²	134.3	72%	0.724	75%	0.746	S	S	*	*			trans	-83.2	96.3	169.6	-55.4	0	0	0	0	109.5	R909	T907-R909 PolarHBondContact O-N 3.15Å
908	I	26.3	Very low	29	Very low	82 Å²	82	133.8 Å²	133.8	42%	0.421	74%	0.743	S	S	.	*			trans	-73.1	117.4	174.1	-54.6	-178.8	0	0	0	108.8	Y227 I906	Y227-I908 HydrophobicContact CE1-CD1 3.95Å; I906-I908 HydrophobicContact CG2-CG1 3.89Å; I906-I908 PolarHBondContact O-N 3.31Å
909	R	22.7	Very low	29	Very low	224 Å²	224	136.4 Å²	136.4	85%	0.845	74%	0.743	S	S	*	*			trans	-83.1	121.8	160.6	-72.5	-175.3	177.2	178.4	-2.9	108.2	T907	T907-R909 PolarHBondContact O-N 3.15Å
910	S	25	Very low	28.3	Very low	68 Å²	68	141.6 Å²	141.6	48%	0.476	75%	0.749	S	S	.	*			trans	-113.8	62.5	173.2	-64.1	0	0	0	0	109.9
911	D	27.2	Very low	28.3	Very low	111 Å²	111	145.4 Å²	145.4	59%	0.594	75%	0.751	S	S	*	*			trans	-113.6	95.1	165.7	-58.9	-56.7	0	0	0	106.8	R356	R356-D911 IonicContact NH2-OD1 2.9Å; R356-D911 PolarHBondContact NH2-OD1 3.13Å
912	T	30.2	Very low	28.6	Very low	138 Å²	138	145.8 Å²	145.8	85%	0.847	75%	0.753	S	S	*	*			trans	-103.5	86.4	168.3	48.9	0	0	0	0	108.1
913	D	31.1	Very low	28.4	Very low	151 Å²	151	146 Å²	146	81%	0.807	76%	0.758	S	S	*	*			trans	-79.3	164.9	160	-81.9	-37.2	0	0	0	109.7
914	E	34.8	Very low	28.5	Very low	195 Å²	195	144.8 Å²	144.8	91%	0.911	76%	0.756	S	S	*	*			trans	-78.8	143.4	-165.2	-58.1	173.9	137.9	0	0	113.2	E916	E914-E916 PolarHBondContact O-N 2.92Å
915	E	30.2	Very low	28.5	Very low	207 Å²	207	145.8 Å²	145.8	97%	0.967	76%	0.763	S	S	*	*			trans	-79.7	111	171.5	-68.8	-172.9	129.5	0	0	110.6
916	E	32.8	Very low	28.3	Very low	174 Å²	174	145.2 Å²	145.2	81%	0.813	76%	0.764	S	S	*	*			trans	-105.7	120.2	164.6	-168.1	175.4	-152.6	0	0	110.7	E914 N918	E914-E916 PolarHBondContact O-N 2.92Å; E916-N918 PolarHBondContact O-N 3.34Å
917	D	32.3	Very low	28.4	Very low	149 Å²	149	148.5 Å²	148.5	80%	0.797	78%	0.782	S	S	*	*			trans	-79.4	109.3	-169.9	-170.6	4	0	0	0	112.1
918	N	29.1	Very low	28.6	Very low	133 Å²	133	152.4 Å²	152.4	71%	0.711	79%	0.789	S	S	*	*			trans	-131.3	93.9	176.2	-97.7	-72.3	0	0	0	113	E916 Y920	E916-N918 PolarHBondContact O-N 3.34Å; N918-Y920 PolarHBondContact O-N 3.43Å
919	K	28.3	Very low	28.9	Very low	191 Å²	191	154.1 Å²	154.1	83%	0.83	81%	0.805	S	S	*	*			trans	-81.6	96.2	-174.3	179.1	-174.8	176.2	178.1	0	113.4
920	Y	26	Very low	29	Very low	221 Å²	221	155.1 Å²	155.1	87%	0.867	81%	0.809	S	S	*	*			trans	-138.9	137.4	164.2	-94.2	-82.2	0	0	0	114.1	N918	N918-Y920 PolarHBondContact O-N 3.43Å
921	K	25.7	Very low	29	Very low	198 Å²	198	157 Å²	157	86%	0.861	82%	0.822	S	S	*	*			trans	-157.2	155.6	170.3	-90.9	-170.8	178.6	177	0	108.6
922	P	37.9	Very low	29	Very low	121 Å²	121	159 Å²	159	79%	0.786	83%	0.833	S	S	*	*			cis	-133.6	171.1	-37.1	38.4	-23.7	0	0	0	112.1
923	S	24.1	Very low	28.7	Very low	127 Å²	127	158.5 Å²	158.5	89%	0.888	83%	0.829	S	S	*	*			trans	-138.2	156.2	154.2	63.9	0	0	0	0	109.1
924	S	26.9	Very low	28.4	Very low	112 Å²	112	159 Å²	159	78%	0.783	83%	0.831	S	S	*	*			trans	-127.5	140.9	-158.6	58.3	0	0	0	0	113.4
925	S	25.8	Very low	28	Very low	115 Å²	115	154.5 Å²	154.5	80%	0.804	82%	0.821	S	S	*	*			trans	175	166.3	136	49	0	0	0	0	113.6
926	S	25.6	Very low	27.7	Very low	119 Å²	119	155.1 Å²	155.1	83%	0.832	82%	0.815	S	S	*	*			trans	78.2	158.6	169.3	80.6	0	0	0	0	118.4
927	L	27.7	Very low	27.4	Very low	165 Å²	165	153.3 Å²	153.3	86%	0.864	82%	0.816	S	S	*	*			trans	-151.5	170.6	-157.9	-81.2	168.1	0	0	0	111.8
928	K	30.1	Very low	27.1	Very low	199 Å²	199	151.4 Å²	151.4	87%	0.865	81%	0.81	S	S	*	*			trans	89.1	159.9	172.6	-49.6	177.2	179.2	179.1	0	114.7
929	P	32.3	Very low	26.9	Very low	118 Å²	118	151.8 Å²	151.8	77%	0.766	82%	0.817	S	S	*	*				-131.6	151.4	-66.9	36	-21.1	0	0	0	113.1
930	R	24.8	Very low	26.9	Very low	246 Å²	246	148.6 Å²	148.6	93%	0.928	81%	0.809	S	S	*	*			trans	-76.4	139.5	165.3	-81.5	-178.3	168.2	145.4	-2.5	110.3
931	S	26.6	Very low	26.8	Very low	106 Å²	106	145.5 Å²	145.5	74%	0.741	81%	0.807	S	S	*	*			trans	-122.8	123.4	162.2	51.9	0	0	0	0	109
932	N	25.9	Very low	26.8	Very low	154 Å²	154	141.6 Å²	141.6	82%	0.824	81%	0.805	S	S	*	*			trans	-106.5	120.4	166.7	-73.1	-7.6	0	0	0	106.3
933	V	24.3	Very low	27.3	Very low	127 Å²	127	140.7 Å²	140.7	77%	0.77	80%	0.799	S	S	*	*			trans	-132.9	109.9	170.4	-177.6	0	0	0	0	108
934	I	25	Very low	27.4	Very low	163 Å²	163	141.6 Å²	141.6	84%	0.836	79%	0.794	S	S	*	*			trans	-115	110.4	161.2	-65.5	177.4	0	0	0	104.9
935	S	26.3	Very low	27.6	Very low	100 Å²	100	141.1 Å²	141.1	70%	0.699	79%	0.791	S	S	*	*			trans	-79.3	126.7	175.8	43	0	0	0	0	110.3
936	Y	24.4	Very low	27.7	Very low	219 Å²	219	142.1 Å²	142.1	86%	0.859	79%	0.787	S	S	*	*			trans	-69.5	144.3	162.9	-76.8	-100.7	0	0	0	109.6
937	V	25.3	Very low	27.8	Very low	137 Å²	137	141.6 Å²	141.6	83%	0.83	78%	0.783	S	S	*	*			trans	-125.1	126.6	153.1	175.7	0	0	0	0	106.6
938	T	27.5	Very low	27.9	Very low	108 Å²	108	138.8 Å²	138.8	66%	0.663	78%	0.777	S	S	*	*			trans	-85.8	148.7	-177.8	42.1	0	0	0	0	111.7
939	V	25.2	Very low	28	Very low	142 Å²	142	137 Å²	137	86%	0.861	78%	0.777	S	S	*	*			trans	-131.6	112.6	143.2	-173.7	0	0	0	0	106.1
940	N	26.8	Very low	27.8	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	78%	0.777	S	S	*	*			trans	-85.4	149.7	163.7	-72.7	0.9	0	0	0	108
941	D	24.1	Very low	28	Very low	155 Å²	155	130.2 Å²	130.2	83%	0.829	77%	0.77	S	S	*	*				-167	160.3	105.5	-88.1	-18.2	0	0	0	111.3
942	S	27	Very low	28.9	Very low	116 Å²	116	130.3 Å²	130.3	81%	0.811	77%	0.768	S	S	*	*			trans	-173.9	165	-167.2	-73.5	0	0	0	0	108.4
943	P	47.1	Very low	28.9	Very low	102 Å²	102	133 Å²	133	66%	0.662	77%	0.768	S	S	*	*			cis	-134.8	-166.2	-29.7	37.9	-18.9	0	0	0	112.7
944	D	27.8	Very low	29	Very low	146 Å²	146	131.5 Å²	131.5	78%	0.781	76%	0.763	S	S	*	*			trans	57	122	150.8	-53.1	-28.6	0	0	0	122.9
945	S	29.9	Very low	29.1	Very low	102 Å²	102	130.2 Å²	130.2	71%	0.713	76%	0.763	S	S	*	*				157.1	135.7	96.7	-117.2	0	0	0	0	115.8
946	D	27.1	Very low	29	Very low	137 Å²	137	132.2 Å²	132.2	73%	0.733	77%	0.766	S	S	*	*			trans	51.7	137.1	142.9	-61.4	-64.4	0	0	0	126.6
947	S	29.1	Very low	29	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	76%	0.759	S	S	*	*			trans	33.9	146.6	133.6	-53.8	0	0	0	0	123.7
948	S	29.4	Very low	29	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	76%	0.758	S	S	*	*			cis	-170.3	138.7	-20.5	52.3	0	0	0	0	111.5
949	L	31.5	Very low	29	Very low	163 Å²	163	128 Å²	128	85%	0.853	76%	0.761	S	S	*	*			trans	43.2	120	159.3	-67.2	171.9	0	0	0	123.1
950	S	29.6	Very low	29.1	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	76%	0.758	S	S	*	*			trans	68.9	123.4	144.5	50.2	0	0	0	0	122.5
951	S	28.8	Very low	29.1	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	77%	0.771	S	S	*	*			trans	-47	165.7	165.9	49.2	0	0	0	0	116.5
952	P	45.4	Very low	29.3	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	78%	0.775	S	S	*	*			cis	-152.9	-176.9	38.5	40.9	-17.6	0	0	0	120.9
953	Y	25.6	Very low	29.3	Very low	210 Å²	210	130.3 Å²	130.3	82%	0.824	77%	0.77	S	S	*	*			trans	79.4	113.2	159.3	-85.7	-77.2	0	0	0	122.8
954	S	26.7	Very low	28.6	Very low	96 Å²	96	133.1 Å²	133.1	67%	0.671	78%	0.78	S	S	*	*			trans	55.5	155.1	133.9	-67.1	0	0	0	0	125.2
955	T	26.1	Very low	28.7	Very low	136 Å²	136	131.7 Å²	131.7	83%	0.834	78%	0.781	S	S	*	*			trans	67.6	130.4	177.6	54.1	0	0	0	0	115.4
956	D	23.9	Very low	28.7	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	78%	0.781	S	S	*	*			cis	95.4	144.1	32.3	-165.4	21.4	0	0	0	113.2
957	T	25.4	Very low	29.7	Very low	118 Å²	118	129.1 Å²	129.1	72%	0.724	78%	0.782	S	S	*	*			trans	63.4	133.9	-166.7	65.7	0	0	0	0	114.6
958	L	25.7	Very low	29.7	Very low	155 Å²	155	130.3 Å²	130.3	81%	0.812	79%	0.785	S	S	*	*			cis	107.4	131	32.8	-94	172.2	0	0	0	113
959	S	26.5	Very low	29.7	Very low	102 Å²	102	132 Å²	132	71%	0.713	79%	0.785	S	S	*	*			trans	70.6	107.7	151.8	-60.2	0	0	0	0	121.4
960	A	27.5	Very low	29.4	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	79%	0.787	S	S	*	*				37.2	130.6	118.5	0	0	0	0	0	121.1
961	L	28.1	Very low	29.3	Very low	178 Å²	178	131.4 Å²	131.4	93%	0.932	79%	0.785	S	S	*	*			trans	-64.7	146.5	168.4	-72.6	160.6	0	0	0	113
962	R	27.6	Very low	29.9	Very low	241 Å²	241	132.6 Å²	132.6	91%	0.909	79%	0.789	S	S	*	*			trans	-68.1	153.1	163.5	-54.1	179.6	-172	-161.7	1.2	108.5
963	G	27.5	Very low	29.1	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	79%	0.794	S	S	*	*			cis	114.3	148.5	35.9	0	0	0	0	0	107.8
964	N	30.6	Very low	29.2	Very low	162 Å²	162	132.3 Å²	132.3	87%	0.866	80%	0.797	S	S	*	*			cis	-132.4	-168.6	8.7	-61.5	-27.9	0	0	0	108.3
965	S	30.5	Very low	29.3	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	80%	0.8	S	S	*	*			cis	-156.5	158.4	15.8	49	0	0	0	0	112
966	G	30.5	Very low	29.5	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	80%	0.796	S	S	*	*			trans	-81.8	-157.7	-179.2	0	0	0	0	0	115.5
967	P	48	Very low	29.7	Very low	116 Å²	116	130 Å²	130	75%	0.753	79%	0.792	S	S	*	*			cis	-142.8	153.4	40.7	39.2	-20.1	0	0	0	119.6
968	V	29.6	Very low	29.9	Very low	133 Å²	133	132 Å²	132	81%	0.806	80%	0.798	S	S	*	*			trans	64.6	134.7	139	177.5	0	0	0	0	118.2
969	L	28.1	Very low	29.9	Very low	141 Å²	141	126.9 Å²	126.9	74%	0.738	78%	0.782	S	S	*	*				-167.3	138.7	64	-153	136.4	0	0	0	114.3
970	E	25.5	Very low	30.1	Very low	190 Å²	190	129.5 Å²	129.5	89%	0.888	79%	0.794	S	S	*	*			trans	56.8	165.4	162.5	-65.9	-175.9	141.7	0	0	124.8
971	G	27.9	Very low	30.2	Very low	71 Å²	71	128.1 Å²	128.1	73%	0.732	79%	0.789	S	S	*	*			trans	-136.5	-137.2	-172.1	0	0	0	0	0	113
972	P	42.4	Very low	30.3	Very low	134 Å²	134	125.6 Å²	125.6	87%	0.87	78%	0.782	S	S	*	*			cis	-142.8	167.2	-2.5	43	-24.8	0	0	0	118.3
973	G	27.6	Very low	30.5	Very low	78 Å²	78	124.7 Å²	124.7	80%	0.804	78%	0.778	S	S	*	*			trans	83.4	165.2	153.5	0	0	0	0	0	119.5
974	R	28.4	Very low	30.5	Very low	235 Å²	235	127 Å²	127	89%	0.887	78%	0.778	S	S	*	*			cis	-167.6	139.5	-7.5	-145.8	-163.7	-176.8	-154.3	1.6	112.8
975	V	28.7	Very low	30.4	Very low	119 Å²	119	126.2 Å²	126.2	72%	0.721	77%	0.773	S	S	*	*			trans	55.5	151.5	140.9	152.5	0	0	0	0	122.3
976	V	28.9	Very low	30.2	Very low	125 Å²	125	127.3 Å²	127.3	76%	0.758	77%	0.768	S	S	*	*			cis	-174.6	168.4	-35.5	87.6	0	0	0	0	110.3
977	A	29.5	Very low	29.9	Very low	81 Å²	81	130 Å²	130	67%	0.669	77%	0.77	S	S	*	*			trans	69	164.8	161.6	0	0	0	0	0	120
978	D	28.1	Very low	30.2	Very low	160 Å²	160	129.8 Å²	129.8	86%	0.856	77%	0.769	S	S	*	*			cis	-175.7	174.3	-43.9	-110.1	-63.2	0	0	0	108.4
979	G	27.6	Very low	31.1	Very low	46 Å²	46	128.4 Å²	128.4	47%	0.474	76%	0.763	S	S	.	*			cis	164.2	143.7	-5.2	0	0	0	0	0	113.8
980	T	30.3	Very low	31.2	Very low	157 Å²	157	129.6 Å²	129.6	96%	0.963	77%	0.769	S	S	*	*			trans	67.2	155	169.4	71.2	0	0	0	0	120.4
981	G	29.8	Very low	31.4	Very low	69 Å²	69	129.2 Å²	129.2	71%	0.711	76%	0.764	S	S	*	*			trans	140.1	70.8	151.2	0	0	0	0	0	123.1
982	T	29.6	Very low	31.6	Very low	126 Å²	126	131.8 Å²	131.8	77%	0.773	77%	0.766	S	S	*	*			trans	16.5	142.2	140.7	53.8	0	0	0	0	125.9
983	R	31.3	Very low	30.9	Very low	222 Å²	222	135.1 Å²	135.1	84%	0.838	77%	0.77	S	S	*	*			trans	87	108.5	136.1	-75.9	165.5	-174.7	-105.9	3.9	124.3
984	T	27.9	Very low	31	Very low	116 Å²	116	138.5 Å²	138.5	71%	0.712	77%	0.769	S	S	*	*				75	117	108.4	-51	0	0	0	0	123.8
985	I	29	Very low	31.1	Very low	146 Å²	146	130.6 Å²	130.6	75%	0.749	76%	0.761	S	S	*	*			trans	96.4	125.7	140.1	-93.5	171.8	0	0	0	124.6
986	I	24.9	Very low	31.1	Very low	139 Å²	139	131 Å²	131	71%	0.713	76%	0.759	S	S	*	*			trans	67.5	113.1	147.6	-65.4	175.3	0	0	0	124
987	V	25.8	Very low	31	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	76%	0.759	S	S	*	*				39.2	146.5	126.1	-171.5	0	0	0	0	121
988	P	52.7	Low	30.9	Very low	112 Å²	112	132.6 Å²	132.6	73%	0.727	76%	0.764	S	S	*	*			cis	-123.3	-114.1	3.6	24.2	4.4	0	0	0	113.1
989	P	49.7	Very low	30.8	Very low	104 Å²	104	131 Å²	131	68%	0.675	76%	0.76	S	S	*	*			cis	-141.8	145.8	-35.1	35.3	-13.3	0	0	0	121
990	L	29.6	Very low	30.7	Very low	166 Å²	166	133 Å²	133	87%	0.869	77%	0.772	S	S	*	*			trans	72	160.4	136.9	-88.1	165.7	0	0	0	127.2
991	K	29.7	Very low	30.6	Very low	183 Å²	183	131.4 Å²	131.4	80%	0.796	76%	0.762	S	S	*	*			trans	74.5	137.9	171.4	-65.5	-176.1	178.1	178.1	0	118.1
992	T	31.2	Very low	30.6	Very low	125 Å²	125	136.8 Å²	136.8	77%	0.767	77%	0.768	S	S	*	*			cis	86.4	126.2	14.2	78.2	0	0	0	0	119.9
993	Q	28.4	Very low	30.4	Very low	204 Å²	204	134.3 Å²	134.3	95%	0.953	76%	0.761	S	S	*	*			trans	-157.1	171.3	147.1	-127.1	-179.3	10.9	0	0	112.7
994	L	29.2	Very low	30.4	Very low	149 Å²	149	129.9 Å²	129.9	78%	0.78	76%	0.764	S	S	*	*			trans	-148.9	161.8	-164.7	-174.8	73.1	0	0	0	109.7
995	G	30.2	Very low	30.4	Very low	69 Å²	69	127.6 Å²	127.6	71%	0.711	76%	0.763	S	S	*	*			trans	-161.8	140.6	168.8	0	0	0	0	0	113.3
996	D	28.6	Very low	30.3	Very low	128 Å²	128	128.5 Å²	128.5	68%	0.684	77%	0.769	S	S	*	*			trans	-125	153.4	-163.6	-68.6	-66	0	0	0	114.5
997	C	26.6	Very low	30.5	Very low	112 Å²	112	129.8 Å²	129.8	76%	0.757	78%	0.776	S	S	*	*			trans	62.8	157.4	145.2	-71.2	0	0	0	0	120
998	T	27.4	Very low	30.5	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	78%	0.778	S	S	*	*			cis	-162.3	168	10.8	-8.7	0	0	0	0	113.8
999	V	26.5	Very low	29.2	Very low	128 Å²	128	130.1 Å²	130.1	78%	0.776	78%	0.776	S	S	*	*			trans	86.9	114	144.9	163	0	0	0	0	122.5
1000	A	26.1	Very low	28	Very low	87 Å²	87	133.7 Å²	133.7	72%	0.719	78%	0.781	S	S	*	*			trans	71.5	151.9	139.8	0	0	0	0	0	123.8
1001	T	28.9	Very low	27.9	Very low	123 Å²	123	132.2 Å²	132.2	76%	0.755	78%	0.779	S	S	*	*			cis	-173.9	154.9	-20.3	-91.3	0	0	0	0	110.7
1002	Q	28.2	Very low	27.7	Very low	182 Å²	182	131.2 Å²	131.2	85%	0.85	78%	0.775	S	S	*	*			trans	79.2	142.9	174.6	-58.8	-121.5	15.6	0	0	116.9
1003	A	27.4	Very low	28.1	Very low	74 Å²	74	130.8 Å²	130.8	61%	0.612	77%	0.774	S	S	*	*			cis	-155.9	167.9	-5.3	0	0	0	0	0	113.2
1004	S	29.3	Very low	28.1	Very low	130 Å²	130	127.6 Å²	127.6	91%	0.909	77%	0.768	S	S	*	*			trans	68.5	124	169.6	-57.6	0	0	0	0	117.6
1005	G	29.1	Very low	28.1	Very low	67 Å²	67	124.1 Å²	124.1	69%	0.691	76%	0.762	S	S	*	*			cis	-160	167.4	-2.3	0	0	0	0	0	112.4
1006	L	27.1	Very low	28.1	Very low	166 Å²	166	126 Å²	126	87%	0.869	76%	0.763	S	S	*	*			trans	-81.3	153.4	-167.9	-71.7	77.6	0	0	0	113.3
1007	L	27.9	Very low	28.2	Very low	166 Å²	166	126.1 Å²	126.1	87%	0.869	77%	0.768	S	S	*	*			cis	90.5	144.5	25.8	-78.4	172.2	0	0	0	117.8
1008	S	26.6	Very low	28.3	Very low	113 Å²	113	126.6 Å²	126.6	79%	0.79	77%	0.773	S	S	*	*			trans	94.1	156.5	159.9	-166.9	0	0	0	0	119.1
1009	N	24.7	Very low	28.4	Very low	130 Å²	130	123.5 Å²	123.5	70%	0.695	77%	0.767	S	S	*	*			cis	179.8	152.9	-48.1	-145	-25.5	0	0	0	109.5
1010	K	24.9	Very low	28.5	Very low	180 Å²	180	126.4 Å²	126.4	78%	0.783	77%	0.772	S	S	*	*			trans	64.3	170.3	167.4	-51.8	178.2	179.7	177.9	0	115.8
1011	T	26.8	Very low	28.6	Very low	135 Å²	135	127.1 Å²	127.1	83%	0.828	77%	0.772	S	S	*	*			cis	-155.1	170.9	15.4	-31.3	0	0	0	0	112.7
1012	K	26	Very low	28.7	Very low	161 Å²	161	126.9 Å²	126.9	70%	0.7	78%	0.775	S	S	*	*			trans	-86.5	162.6	171.1	-63.3	-176.8	178.6	-179.4	0	113.4
1013	P	39.8	Very low	28.7	Very low	117 Å²	117	122 Å²	122	76%	0.76	77%	0.773	S	S	*	*				-130.9	165	99.4	8.5	15	0	0	0	113.1
1014	V	28.8	Very low	28.6	Very low	136 Å²	136	123.7 Å²	123.7	82%	0.824	78%	0.779	S	S	*	*			cis	80.3	132.2	41.4	179.5	0	0	0	0	111.9
1015	A	29.7	Very low	28.4	Very low	77 Å²	77	122.1 Å²	122.1	64%	0.636	77%	0.767	S	S	*	*			cis	-148.5	151.3	26.9	0	0	0	0	0	113.8
1016	S	30.1	Very low	28.3	Very low	107 Å²	107	125.5 Å²	125.5	75%	0.748	77%	0.768	S	S	*	*				73.8	144.4	92	82.5	0	0	0	0	116.4
1017	V	29.2	Very low	28.7	Very low	131 Å²	131	124.2 Å²	124.2	79%	0.794	77%	0.767	S	S	*	*			cis	-157.7	150.6	37	179.3	0	0	0	0	108.2
1018	S	29.8	Very low	29.1	Very low	122 Å²	122	121.4 Å²	121.4	85%	0.853	76%	0.759	S	S	*	*			cis	-143.9	-128.9	-10.8	50.6	0	0	0	0	109.5
1019	G	28.4	Very low	29.1	Very low	62 Å²	62	122.9 Å²	122.9	64%	0.639	76%	0.763	S	S	*	*			cis	176.8	-170	5.3	0	0	0	0	0	115.3
1020	Q	28.8	Very low	29.1	Very low	189 Å²	189	120 Å²	120	88%	0.883	77%	0.765	S	S	*	*			trans	7.9	102.5	171.9	-63.9	-172.4	21.3	0	0	118.6
1021	S	29.7	Very low	29.2	Very low	102 Å²	102	123 Å²	123	71%	0.713	77%	0.773	S	S	*	*				94.4	136.8	70.2	67.6	0	0	0	0	113.1
1022	S	29.7	Very low	29.2	Very low	117 Å²	117	127.9 Å²	127.9	82%	0.818	78%	0.776	S	S	*	*			cis	-150	177.2	21	-58.7	0	0	0	0	113
1023	G	28	Very low	29.2	Very low	79 Å²	79	124.8 Å²	124.8	81%	0.814	78%	0.781	S	S	*	*			trans	-80.6	-164	179.1	0	0	0	0	0	116.3
1024	C	25.5	Very low	28.6	Very low	110 Å²	110	128.5 Å²	128.5	74%	0.743	79%	0.788	S	S	*	*			cis	-159.8	163.8	15.4	-171.3	0	0	0	0	113.3
1025	C	26.4	Very low	28.6	Very low	98 Å²	98	133.7 Å²	133.7	66%	0.662	79%	0.793	S	S	*	*			trans	24.3	151.9	140.9	56.7	0	0	0	0	122.2
1026	I	27.4	Very low	28.5	Very low	137 Å²	137	134 Å²	134	70%	0.703	80%	0.804	S	S	*	*				-169.3	156.1	65.4	-80.6	178	0	0	0	111	P1028	I1026-P1028 HydrophobicContact CG2-CG 3.93Å
1027	T	34.6	Very low	28.3	Very low	140 Å²	140	132 Å²	132	86%	0.859	80%	0.8	S	S	*	*			trans	-131.1	145.7	147.6	54.8	0	0	0	0	110.9
1028	P	36.3	Very low	28.2	Very low	106 Å²	106	133.3 Å²	133.3	69%	0.688	81%	0.808	S	S	*	*			trans	-144.1	134	159.4	27.8	-5	0	0	0	116.3	I1026	I1026-P1028 HydrophobicContact CG2-CG 3.93Å
1029	T	26.4	Very low	28.1	Very low	144 Å²	144	130.3 Å²	130.3	88%	0.883	80%	0.797	S	S	*	*			trans	5.7	139.6	143.6	57	0	0	0	0	121.5
1030	G	25.8	Very low	28.1	Very low	71 Å²	71	131.9 Å²	131.9	73%	0.732	80%	0.804	S	S	*	*			trans	-161.2	54.1	177.1	0	0	0	0	0	120.7
1031	Y	26.6	Very low	28.1	Very low	241 Å²	241	127.8 Å²	127.8	95%	0.945	80%	0.802	S	S	*	*			trans	66	173.8	153.3	-83.2	-85.1	0	0	0	122.8
1032	R	26.9	Very low	28.2	Very low	239 Å²	239	131.7 Å²	131.7	90%	0.902	81%	0.809	S	S	*	*			trans	-149.8	120.6	-160.5	167.8	-158	-175.8	-172.9	4.8	111.4
1033	A	26.1	Very low	28.6	Very low	96 Å²	96	131.6 Å²	131.6	79%	0.793	81%	0.806	S	S	*	*			trans	-175	159.6	166.1	0	0	0	0	0	110.3
1034	Q	25.8	Very low	28.5	Very low	194 Å²	194	135.9 Å²	135.9	91%	0.907	81%	0.809	S	S	*	*			cis	-157.4	179.1	-28.8	-113.5	-156.9	14.5	0	0	109.1
1035	R	30.5	Very low	28.5	Very low	246 Å²	246	137.8 Å²	137.8	93%	0.928	81%	0.812	S	S	*	*			trans	-95.5	151.6	171.7	-86	-176.1	172.6	179.9	-1.9	111.8
1036	G	25.7	Very low	28.6	Very low	84 Å²	84	140.7 Å²	140.7	87%	0.866	82%	0.82	S	S	*	*			trans	140	146.6	159.2	0	0	0	0	0	113.4
1037	G	27	Very low	28.6	Very low	65 Å²	65	138.4 Å²	138.4	67%	0.67	82%	0.816	S	S	*	*			cis	165.1	137.9	-10.4	0	0	0	0	0	113.4
1038	T	27.7	Very low	28.3	Very low	157 Å²	157	139.6 Å²	139.6	96%	0.963	81%	0.812	S	S	*	*			trans	53.7	133.5	157.1	54	0	0	0	0	121.7
1039	G	26.7	Very low	27.7	Very low	60 Å²	60	140.4 Å²	140.4	62%	0.619	81%	0.81	S	S	*	*			trans	175.8	124.3	159.4	0	0	0	0	0	111.9	A621	A621-G1039 VanDerWaalsContact CB-O 3.31Å; A621-G1039 WeakPolarHBondContact CB-O 3.35Å
1040	A	28.7	Very low	27.8	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	80%	0.801	S	S	*	*			trans	-147.1	144.7	-174.6	0	0	0	0	0	112.9
1041	A	28.8	Very low	27.9	Very low	103 Å²	103	145.4 Å²	145.4	85%	0.851	81%	0.805	S	S	*	*			trans	-168.9	149.2	159.8	0	0	0	0	0	111.4
1042	Q	32	Very low	27.9	Very low	183 Å²	183	139 Å²	139	86%	0.855	80%	0.796	S	S	*	*			trans	-106.7	173.4	153.9	-66.8	-167.7	-17.9	0	0	108.9
1043	P	37.8	Very low	27.8	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	79%	0.793	S	S	*	*				-152.2	151.2	92.9	38.4	-20.6	0	0	0	118
1044	L	25.5	Very low	27.7	Very low	169 Å²	169	133.6 Å²	133.6	89%	0.885	79%	0.794	S	S	*	*			trans	66.3	-177.7	141.8	-69	168.2	0	0	0	120.8
1045	N	26	Very low	27.7	Very low	151 Å²	151	128.7 Å²	128.7	81%	0.807	79%	0.787	S	S	*	*			trans	-155.9	-178.3	-146.8	-168.6	-4.8	0	0	0	110.3
1046	L	28.7	Very low	28.3	Very low	159 Å²	159	123 Å²	123	83%	0.832	78%	0.782	S	S	*	*			trans	105	143.3	179.2	-63.7	164.1	0	0	0	114.4
1047	S	27.7	Very low	28.2	Very low	89 Å²	89	122.8 Å²	122.8	62%	0.622	77%	0.772	S	S	*	*			cis	-168.9	178.9	-4.7	49.9	0	0	0	0	113.9
1048	Q	27.2	Very low	28.1	Very low	165 Å²	165	124.3 Å²	124.3	77%	0.771	77%	0.773	S	S	*	*			trans	75	148.2	164.6	-58.5	-179.2	12.2	0	0	117.6
1049	N	24.9	Very low	28	Very low	122 Å²	122	124.7 Å²	124.7	65%	0.652	76%	0.763	S	S	*	*			cis	-152.9	146.7	-15.8	-109.7	-9.5	0	0	0	108.1
1050	Q	27.7	Very low	27.9	Very low	149 Å²	149	128 Å²	128	70%	0.696	76%	0.762	S	S	*	*				53.9	140.8	84.4	-104.1	-167.9	81.4	0	0	115.4
1051	Q	28.5	Very low	27.7	Very low	171 Å²	171	133.3 Å²	133.3	80%	0.799	76%	0.762	S	S	*	*			cis	-118.7	-138	15.5	-65.2	-159.6	-44.9	0	0	115.5
1052	S	26.4	Very low	27.5	Very low	108 Å²	108	133.5 Å²	133.5	76%	0.755	76%	0.757	S	S	*	*			trans	-168.4	-163.4	-156.4	69.5	0	0	0	0	113.8
1053	S	25.5	Very low	27.2	Very low	120 Å²	120	130.3 Å²	130.3	84%	0.839	76%	0.755	S	S	*	*			trans	86.7	152.5	170.7	83	0	0	0	0	117.2
1054	A	23.1	Very low	26.8	Very low	100 Å²	100	132.4 Å²	132.4	83%	0.826	76%	0.76	S	S	*	*			cis	-144.6	171.9	10.4	0	0	0	0	0	114.5
1055	A	25.2	Very low	27.3	Very low	91 Å²	91	130.1 Å²	130.1	75%	0.752	76%	0.756	S	S	*	*			trans	-111.7	-171.6	171.3	0	0	0	0	0	109.2
1056	P	42.6	Very low	27.3	Very low	126 Å²	126	127 Å²	127	82%	0.818	75%	0.751	S	S	*	*			cis	-124	-141.2	5.1	29.2	-1.4	0	0	0	111.3
1057	A	24.4	Very low	28.2	Very low	80 Å²	80	124.7 Å²	124.7	66%	0.661	75%	0.745	S	S	*	*			cis	-161.5	165.7	10	0	0	0	0	0	116.7
1058	S	25.9	Very low	28.2	Very low	98 Å²	98	132.2 Å²	132.2	69%	0.685	76%	0.76	S	S	*	*			trans	-4.4	163.7	152.9	58.7	0	0	0	0	125.3
1059	Q	25	Very low	28.2	Very low	165 Å²	165	134.5 Å²	134.5	77%	0.771	76%	0.761	S	S	*	*			trans	76.6	148.5	160.3	-76.3	-176	-67.1	0	0	117.7
1060	E	24.3	Very low	28.3	Very low	128 Å²	128	136 Å²	136	60%	0.598	76%	0.764	S	S	*	*			cis	-161.5	170.4	-24.9	-138.2	-173.9	115.6	0	0	110.4
1061	R	25.1	Very low	28.3	Very low	208 Å²	208	137.6 Å²	137.6	79%	0.785	77%	0.772	S	S	*	*			trans	47.2	111.8	152	-80.5	177.3	-177.3	-152.2	-9.7	122.8
1062	S	24	Very low	28.1	Very low	106 Å²	106	133.8 Å²	133.8	74%	0.741	77%	0.77	S	S	*	*				40.5	125	123.5	65.8	0	0	0	0	122.8
1063	S	25	Very low	28	Very low	116 Å²	116	138 Å²	138	81%	0.811	78%	0.775	S	S	*	*				-178.9	133.1	112.3	59.6	0	0	0	0	114.2
1064	N	29.2	Very low	28.1	Very low	160 Å²	160	138.5 Å²	138.5	86%	0.856	77%	0.773	S	S	*	*			trans	-75.8	162.5	152.9	-85.4	-29.5	0	0	0	109.2
1065	P	36.1	Very low	28.5	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	77%	0.766	S	S	*	*			cis	-145.4	-170.9	32.6	41.4	-19.9	0	0	0	117.1
1066	A	26.5	Very low	29.5	Very low	85 Å²	85	138.7 Å²	138.7	70%	0.702	77%	0.765	S	S	*	*			trans	-78.7	-169.7	162.5	0	0	0	0	0	111.2
1067	P	48.7	Very low	28.9	Very low	110 Å²	110	140.6 Å²	140.6	71%	0.714	77%	0.767	S	S	*	*			cis	-135.8	-176.7	-5.9	43.1	-26.8	0	0	0	114.6
1068	R	27	Very low	29.3	Very low	248 Å²	248	141.4 Å²	141.4	94%	0.936	77%	0.768	S	S	*	*			trans	-178.4	-177	133.1	-99.6	161.1	-175.2	173.3	2.4	115.1
1069	R	27	Very low	29.4	Very low	213 Å²	213	146.2 Å²	146.2	80%	0.804	78%	0.78	S	S	*	*			trans	-135.6	172.1	-143	-162.3	-166.1	-171.8	-165	5.8	111.4
1070	Q	26.7	Very low	29.8	Very low	152 Å²	152	142.6 Å²	142.6	71%	0.71	78%	0.778	S	S	*	*			trans	76	142.5	168.6	-64.8	163.9	-54.8	0	0	115.3
1071	Q	27.7	Very low	30.9	Very low	183 Å²	183	141.3 Å²	141.3	86%	0.855	78%	0.781	S	S	*	*			cis	103.7	136.5	20.6	-81.4	-169.9	-38.3	0	0	115.6
1072	A	24.6	Very low	31.1	Very low	92 Å²	92	141.5 Å²	141.5	76%	0.76	78%	0.783	S	S	*	*			trans	96.5	106.2	151.8	0	0	0	0	0	121.8
1073	F	25.5	Very low	31.2	Very low	196 Å²	196	143 Å²	143	86%	0.86	79%	0.788	S	S	*	*				63.7	121	122.6	-90	-118	0	0	0	124.5
1074	V	27.3	Very low	31.3	Very low	131 Å²	131	146.6 Å²	146.6	79%	0.794	79%	0.789	S	S	*	*			trans	81.1	145.6	133.7	169.3	0	0	0	0	120.8
1075	A	30.7	Very low	31.2	Very low	84 Å²	84	147 Å²	147	69%	0.694	79%	0.786	S	S	*	*			trans	-107.3	177.8	-179.1	0	0	0	0	0	112.2
1076	P	46.3	Very low	30.9	Very low	111 Å²	111	149.8 Å²	149.8	72%	0.721	79%	0.788	S	S	*	*				-156	170.8	94.7	41.2	-23.2	0	0	0	117.3
1077	L	30.2	Very low	30.9	Very low	165 Å²	165	149.5 Å²	149.5	86%	0.864	79%	0.793	S	S	*	*			trans	43.7	152.3	141.6	-64.5	168	0	0	0	121.7
1078	S	32.7	Very low	30.1	Very low	97 Å²	97	150 Å²	150	68%	0.678	80%	0.799	S	S	*	*			cis	-172.1	157.7	-10.2	50.8	0	0	0	0	111
1079	Q	28.2	Very low	30.9	Very low	199 Å²	199	144 Å²	144	93%	0.93	79%	0.792	S	S	*	*			trans	175.8	163.5	139.6	-99.9	176.3	12.4	0	0	112.4
1080	A	33.5	Very low	31	Very low	89 Å²	89	140.9 Å²	140.9	74%	0.736	79%	0.791	S	S	*	*			trans	-142	174.8	175.7	0	0	0	0	0	108.8
1081	P	46.8	Very low	31.1	Very low	101 Å²	101	141.6 Å²	141.6	66%	0.656	79%	0.794	S	S	*	*				-162	169.3	83.4	44.5	-24.7	0	0	0	119.2
1082	Y	30.1	Very low	31.2	Very low	213 Å²	213	137.7 Å²	137.7	84%	0.835	79%	0.787	S	S	*	*			trans	59	158.1	160.3	-58.2	-59	0	0	0	119.2
1083	T	25.6	Very low	31.4	Very low	137 Å²	137	140 Å²	140	84%	0.84	79%	0.791	S	S	*	*			cis	-138.6	-156.2	4.4	-23.5	0	0	0	0	112
1084	F	28	Very low	31.5	Very low	192 Å²	192	134.2 Å²	134.2	84%	0.842	79%	0.788	S	S	*	*			trans	-136.9	164.3	-155.7	-130.7	-81.1	0	0	0	115.4
1085	Q	26.8	Very low	31.8	Very low	169 Å²	169	136.9 Å²	136.9	79%	0.79	79%	0.791	S	S	*	*			trans	96.7	144.2	155.8	-69.7	-159.2	-4	0	0	123.9
1086	H	29.8	Very low	32.8	Very low	179 Å²	179	138.1 Å²	138.1	83%	0.829	79%	0.792	S	S	*	*			trans	-45.9	158.1	179.9	-57.4	-97.9	0	0	0	120.7
1087	G	26.3	Very low	32.3	Very low	78 Å²	78	140.6 Å²	140.6	80%	0.804	79%	0.794	S	S	*	*			trans	157.5	126	147.8	0	0	0	0	0	117
1088	S	31.5	Very low	32.4	Very low	121 Å²	121	139.6 Å²	139.6	85%	0.846	79%	0.789	S	S	*	*			trans	-104.6	153.1	162.1	-46.9	0	0	0	0	108.4
1089	P	43.8	Very low	32.2	Very low	122 Å²	122	138.6 Å²	138.6	79%	0.792	79%	0.786	S	S	*	*				-158	-167.6	70.4	42.4	-19.1	0	0	0	118.2
1090	L	28.1	Very low	33.5	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	78%	0.777	S	S	*	*			trans	-25.3	148.2	176.8	-76.7	69.4	0	0	0	124.4
1091	H	29.4	Very low	33.3	Very low	167 Å²	167	134.6 Å²	134.6	77%	0.773	78%	0.777	S	S	*	*			trans	81.3	108.7	133.4	-83.2	-130	0	0	0	125.8
1092	S	29.7	Very low	33.9	Very low	101 Å²	101	135.8 Å²	135.8	71%	0.706	79%	0.785	S	S	*	*				75.9	154.8	115.5	-149	0	0	0	0	125
1093	T	29.8	Very low	34.1	Very low	140 Å²	140	129.1 Å²	129.1	86%	0.859	77%	0.774	S	S	*	*			trans	74.7	147.3	173.7	71.1	0	0	0	0	117.9
1094	G	26.9	Very low	34.4	Very low	76 Å²	76	130.9 Å²	130.9	78%	0.784	77%	0.772	S	S	*	*			cis	-165.1	-175.8	3.3	0	0	0	0	0	116
1095	H	33.4	Very low	34.6	Very low	187 Å²	187	129.1 Å²	129.1	87%	0.866	77%	0.771	S	S	*	*			trans	-85.5	-172.2	-170.6	-105.2	-54.7	0	0	0	114.2
1096	P	51.9	Low	36.1	Very low	110 Å²	110	125.8 Å²	125.8	71%	0.714	76%	0.764	S	S	*	*			cis	-128.2	-158.2	20.2	43.5	-23.3	0	0	0	113.2
1097	H	35.9	Very low	36.1	Very low	162 Å²	162	122 Å²	122	75%	0.75	76%	0.757	S	S	*	*			cis	-142.8	-137.3	1.4	-153.7	-1.2	0	0	0	110.3
1098	L	31.9	Very low	36.5	Very low	145 Å²	145	126.1 Å²	126.1	76%	0.759	76%	0.756	S	S	*	*			cis	-155.2	169.2	2.2	-134.7	-176.7	0	0	0	109.3
1099	A	29.7	Very low	36.6	Very low	76 Å²	76	123.4 Å²	123.4	63%	0.628	74%	0.74	S	S	*	*			trans	-162.9	-169.5	-178.9	0	0	0	0	0	109.8
1100	P	54.3	Low	36	Very low	115 Å²	115	125.2 Å²	125.2	75%	0.747	74%	0.738	S	S	*	*			cis	-140.3	-173.8	-6.2	43.3	-25.2	0	0	0	116.1
1101	A	29.7	Very low	36	Very low	88 Å²	88	124.4 Å²	124.4	73%	0.727	73%	0.734	S	S	*	*			trans	71.6	167.5	143.3	0	0	0	0	0	119.8
1102	P	58.4	Low	35.9	Very low	126 Å²	126	126 Å²	126	82%	0.818	74%	0.735	S	S	*	*			cis	-82.9	-174.3	-8.5	36.4	-36.5	0	0	0	113
1103	A	36	Very low	35.6	Very low	74 Å²	74	126.3 Å²	126.3	61%	0.612	73%	0.732	S	S	*	*			cis	-176.8	173.3	-40	0	0	0	0	0	105.9
1104	H	31.2	Very low	35.4	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.806	73%	0.733	S	S	*	*			cis	-129.2	-173.8	4.2	-57.9	-105.1	0	0	0	107.3
1105	L	32	Very low	35.4	Very low	155 Å²	155	131.2 Å²	131.2	81%	0.812	73%	0.733	S	S	*	*			cis	68.9	140.4	21.5	-71.3	172.7	0	0	0	116.5
1106	P	58.3	Low	35.3	Very low	99 Å²	99	126.6 Å²	126.6	64%	0.643	73%	0.728	S	S	*	*			cis	-72.1	-138.1	-17.5	36.5	-37.1	0	0	0	110
1107	S	30.2	Very low	34.9	Very low	98 Å²	98	126.6 Å²	126.6	69%	0.685	73%	0.728	S	S	*	*			cis	-167.6	156.7	-0.4	36.6	0	0	0	0	107.6
1108	Q	33.8	Very low	34.5	Very low	165 Å²	165	124.5 Å²	124.5	77%	0.771	73%	0.726	S	S	*	*			cis	-176.4	151.8	-25.7	-109.2	155.1	-98.9	0	0	105.5
1109	A	34.8	Very low	34.4	Very low	64 Å²	64	123 Å²	123	53%	0.529	73%	0.729	S	S	.	*			cis	-173.6	-172.8	-22.7	0	0	0	0	0	107.6
1110	H	30.7	Very low	34.3	Very low	161 Å²	161	124.3 Å²	124.3	75%	0.745	74%	0.739	S	S	*	*			trans	76.3	147.1	165	-44.4	-77.3	0	0	0	117.7
1111	L	27.3	Very low	33.1	Very low	130 Å²	130	123.9 Å²	123.9	68%	0.681	75%	0.745	S	S	*	*			cis	-157.3	146.8	-25.2	-107.5	-167.6	0	0	0	112.2
1112	Y	27.7	Very low	32.9	Very low	200 Å²	200	123.6 Å²	123.6	78%	0.784	74%	0.743	S	S	*	*			trans	47.2	121.8	146.2	-80.5	-43.3	0	0	0	125.4
1113	T	24	Very low	31.5	Very low	108 Å²	108	126.3 Å²	126.3	66%	0.663	75%	0.749	S	S	*	*				110.3	106.6	113.7	-72.4	0	0	0	0	122.2
1114	Y	26.2	Very low	30.9	Very low	222 Å²	222	126 Å²	126	87%	0.871	75%	0.753	S	S	*	*			trans	67.3	141.6	136.4	-85.9	-105.9	0	0	0	126.3
1115	A	26.5	Very low	30.8	Very low	96 Å²	96	122.7 Å²	122.7	79%	0.793	75%	0.75	S	S	*	*			trans	84.5	152.4	141.4	0	0	0	0	0	122.1
1116	A	30.5	Very low	30.6	Very low	90 Å²	90	121.1 Å²	121.1	74%	0.744	75%	0.747	S	S	*	*			trans	-108.4	177.3	172.1	0	0	0	0	0	109.5
1117	P	43.4	Very low	29.1	Very low	111 Å²	111	121.2 Å²	121.2	72%	0.721	75%	0.75	S	S	*	*				-161.6	-174.5	68.9	44.8	-21.8	0	0	0	118.3
1118	T	28.3	Very low	29	Very low	117 Å²	117	121.8 Å²	121.8	72%	0.718	75%	0.754	S	S	*	*			trans	19.5	137	145.2	58.2	0	0	0	0	125.3
1119	S	28.8	Very low	28.8	Very low	115 Å²	115	121.3 Å²	121.3	80%	0.804	76%	0.755	S	S	*	*				72.5	127.6	125.2	-59.4	0	0	0	0	124.8
1120	A	27.8	Very low	28.4	Very low	103 Å²	103	122.4 Å²	122.4	85%	0.851	76%	0.764	S	S	*	*			trans	7.8	128	144.4	0	0	0	0	0	122.9
1121	A	28.6	Very low	28.4	Very low	105 Å²	105	122.8 Å²	122.8	87%	0.868	77%	0.766	S	S	*	*			trans	-169.6	171.3	141.5	0	0	0	0	0	110
1122	A	27.2	Very low	28.4	Very low	83 Å²	83	123.5 Å²	123.5	69%	0.686	77%	0.77	S	S	*	*				173.5	165.6	-51.8	0	0	0	0	0	108.8
1123	L	28.3	Very low	28.4	Very low	182 Å²	182	122.7 Å²	122.7	95%	0.953	77%	0.771	S	S	*	*			trans	69.2	155	174.7	-49.3	162.3	0	0	0	114.3
1124	G	23.6	Very low	28.7	Very low	67 Å²	67	122.6 Å²	122.6	69%	0.691	77%	0.774	S	S	*	*			cis	171.3	154.9	-1.9	0	0	0	0	0	107.2
1125	S	28.2	Very low	29.9	Very low	105 Å²	105	116.3 Å²	116.3	73%	0.734	76%	0.76	S	S	*	*			cis	-169.6	163.2	33.5	-67.9	0	0	0	0	112.7
1126	T	29.1	Very low	30.1	Very low	123 Å²	123	120.8 Å²	120.8	76%	0.755	77%	0.765	S	S	*	*			trans	53.9	118.6	147.2	51.2	0	0	0	0	122.8
1127	S	26.2	Very low	30	Very low	100 Å²	100	119.7 Å²	119.7	70%	0.699	76%	0.762	S	S	*	*				14.9	144.9	121.6	61.8	0	0	0	0	119.7
1128	S	28.3	Very low	29.5	Very low	110 Å²	110	120 Å²	120	77%	0.769	77%	0.768	S	S	*	*				-164.1	164.2	56	-68.9	0	0	0	0	116.5
1129	I	28.6	Very low	29.7	Very low	155 Å²	155	119 Å²	119	80%	0.795	77%	0.765	S	S	*	*			trans	-34.7	136.2	158.4	-63.1	151.4	0	0	0	114.9
1130	A	28.2	Very low	29.8	Very low	87 Å²	87	124 Å²	124	72%	0.719	77%	0.766	S	S	*	*				174.7	117.8	124.6	0	0	0	0	0	115.9
1131	H	29.8	Very low	30.3	Very low	170 Å²	170	127.6 Å²	127.6	79%	0.787	77%	0.765	S	S	*	*				42.9	149.6	127	-74.5	-84.7	0	0	0	125.9
1132	L	28	Very low	30.3	Very low	145 Å²	145	127.3 Å²	127.3	76%	0.759	76%	0.763	S	S	*	*			trans	87	97.8	146.8	-74.3	154	0	0	0	121.3
1133	F	27.2	Very low	30.3	Very low	183 Å²	183	127.8 Å²	127.8	80%	0.803	77%	0.767	S	S	*	*				51.1	111.3	121	-85	-110.6	0	0	0	121.5
1134	S	28.9	Very low	30.6	Very low	106 Å²	106	123.9 Å²	123.9	74%	0.741	76%	0.761	S	S	*	*				65	178.8	110.6	-118.4	0	0	0	0	119.7
1135	P	52	Low	31.4	Very low	89 Å²	89	131.2 Å²	131.2	58%	0.578	77%	0.769	S	S	*	*			cis	-134.1	-168.5	-14.3	42.3	-25.6	0	0	0	114.5
1136	Q	30.4	Very low	32.4	Very low	190 Å²	190	132.1 Å²	132.1	89%	0.888	77%	0.771	S	S	*	*			trans	69.6	153.1	153.6	-71.5	163.8	14.3	0	0	119.6
1137	G	29.2	Very low	32.4	Very low	67 Å²	67	131.6 Å²	131.6	69%	0.691	77%	0.767	S	S	*	*			cis	149.9	135	-14.3	0	0	0	0	0	115.9
1138	S	33.8	Very low	32.7	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	78%	0.775	S	S	*	*			trans	68.5	137.8	170.9	-68.4	0	0	0	0	117.3
1139	S	31.8	Very low	33.8	Very low	96 Å²	96	135.7 Å²	135.7	67%	0.671	77%	0.773	S	S	*	*				74.2	136.7	63.7	125.7	0	0	0	0	112.9
1140	R	31.3	Very low	33.9	Very low	219 Å²	219	133.3 Å²	133.3	83%	0.826	77%	0.77	S	S	*	*			cis	-160.1	-178.3	22.7	-121.4	166.8	-174.6	-172.9	2.9	112.6
1141	H	38.2	Very low	34	Very low	178 Å²	178	135 Å²	135	82%	0.824	77%	0.772	S	S	*	*			trans	-54.4	160.3	180	-38	-94.6	0	0	0	117.6
1142	A	27.6	Very low	34.1	Very low	99 Å²	99	134.4 Å²	134.4	82%	0.818	77%	0.773	S	S	*	*				-176	150.7	122.7	0	0	0	0	0	116.4
1143	A	27.7	Very low	34.2	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	77%	0.772	S	S	*	*			trans	59.9	121.1	140.3	0	0	0	0	0	125.4
1144	A	34.6	Very low	34.3	Very low	100 Å²	100	131.6 Å²	131.6	83%	0.826	77%	0.766	S	S	*	*				58.2	134.3	120.8	0	0	0	0	0	124.6
1145	Y	40	Very low	34.2	Very low	220 Å²	220	134.5 Å²	134.5	86%	0.863	77%	0.768	S	S	*	*			trans	-74.4	169.8	154.4	-62.1	-105.6	0	0	0	109.7
1146	T	49.3	Very low	33.1	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	78%	0.779	S	S	*	*			cis	-156.4	-174.2	22.9	-27	0	0	0	0	110.1
1147	T	29.6	Very low	33.8	Very low	112 Å²	112	133.4 Å²	133.4	69%	0.687	78%	0.775	S	S	*	*			trans	-31	125.6	170.1	48.3	0	0	0	0	117.1
1148	H	32.1	Very low	34	Very low	184 Å²	184	137 Å²	137	85%	0.852	78%	0.783	S	S	*	*			trans	174.7	151.8	136.2	-83.8	-53.8	0	0	0	109.4
1149	P	52.1	Low	33.9	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	78%	0.778	S	S	*	*			trans	-97.9	164	179.2	37.1	-34	0	0	0	114.7
1150	S	29.3	Very low	33.8	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	79%	0.787	S	S	*	*			trans	91.9	103.4	159.8	-53	0	0	0	0	120.4
1151	T	31.1	Very low	33.8	Very low	124 Å²	124	131.1 Å²	131.1	76%	0.761	78%	0.779	S	S	*	*			trans	59.9	122.5	133.7	55.8	0	0	0	0	123.6
1152	L	31.9	Very low	34.6	Very low	157 Å²	157	128.5 Å²	128.5	82%	0.822	78%	0.778	S	S	*	*			trans	75.7	118.4	136.2	-64.9	168.3	0	0	0	122.4
1153	V	29.9	Very low	34.9	Very low	119 Å²	119	128.9 Å²	128.9	72%	0.721	77%	0.774	S	S	*	*				83.2	118.9	129.4	173.8	0	0	0	0	121.9
1154	H	29.4	Very low	35.2	Very low	150 Å²	150	131.4 Å²	131.4	69%	0.694	77%	0.774	S	S	*	*			trans	68.3	131.3	148.4	-88.8	38.8	0	0	0	124.3
1155	Q	26.1	Very low	35.1	Very low	167 Å²	167	134 Å²	134	78%	0.78	77%	0.773	S	S	*	*			trans	68.1	136.7	133.6	-67.2	-180	-5.3	0	0	125.3
1156	V	29.2	Very low	34.8	Very low	133 Å²	133	129.3 Å²	129.3	81%	0.806	77%	0.768	S	S	*	*			trans	-49.3	148.5	157.9	175.4	0	0	0	0	112.3
1157	P	44.7	Very low	34	Very low	122 Å²	122	129.1 Å²	129.1	79%	0.792	77%	0.771	S	S	*	*				-147.1	-165.5	57.5	33.2	-7.1	0	0	0	118
1158	V	35.2	Very low	34.2	Very low	144 Å²	144	128.1 Å²	128.1	87%	0.873	77%	0.774	S	S	*	*			trans	-143.6	157.2	-163.6	-178.3	0	0	0	0	114.3
1159	S	31.1	Very low	34.3	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	77%	0.772	S	S	*	*			trans	-154.2	-176.6	170.4	49.2	0	0	0	0	110.8
1160	V	29.6	Very low	33.1	Very low	143 Å²	143	126.1 Å²	126.1	87%	0.867	78%	0.778	S	S	*	*			cis	-154.6	-171.2	20.3	-135.3	0	0	0	0	112.3
1161	G	30.4	Very low	33.1	Very low	64 Å²	64	125.2 Å²	125.2	66%	0.66	78%	0.777	S	S	*	*			trans	-141.6	-157.1	163.6	0	0	0	0	0	110.9
1162	P	55.8	Low	33.6	Very low	124 Å²	124	125.4 Å²	125.4	81%	0.805	78%	0.78	S	S	*	*			cis	-139.1	-170.4	-9.3	43.7	-25.7	0	0	0	115.4
1163	S	33	Very low	33.3	Very low	106 Å²	106	122.3 Å²	122.3	74%	0.741	78%	0.777	S	S	*	*			trans	151.5	133.5	135.8	-70.6	0	0	0	0	121.8
1164	L	35	Very low	33.2	Very low	148 Å²	148	125.3 Å²	125.3	78%	0.775	78%	0.783	S	S	*	*			trans	75	111.2	138.1	-63.8	169.1	0	0	0	128.7
1165	L	33.2	Very low	33.1	Very low	154 Å²	154	128.3 Å²	128.3	81%	0.806	79%	0.79	S	S	*	*			trans	48.6	165.3	130.1	-49.9	-179.8	0	0	0	124.4
1166	T	32.7	Very low	33.1	Very low	121 Å²	121	128.6 Å²	128.6	74%	0.742	79%	0.791	S	S	*	*			cis	-153.9	170.4	21.7	50.7	0	0	0	0	115.5
1167	S	31.8	Very low	33.1	Very low	120 Å²	120	129.3 Å²	129.3	84%	0.839	79%	0.785	S	S	*	*			trans	78.7	171.5	162.3	83.6	0	0	0	0	118.8
1168	A	35.6	Very low	32.2	Very low	91 Å²	91	129.8 Å²	129.8	75%	0.752	78%	0.777	S	S	*	*			cis	179.2	179.7	-30.2	0	0	0	0	0	108.2
1169	S	32.3	Very low	31.8	Very low	115 Å²	115	132 Å²	132	80%	0.804	78%	0.776	S	S	*	*			cis	-165	-174.7	-37.8	64.8	0	0	0	0	106.8
1170	V	27	Very low	31.7	Very low	140 Å²	140	131.6 Å²	131.6	85%	0.848	78%	0.778	S	S	*	*			cis	-163	178.6	-1.7	70.2	0	0	0	0	109.8
1171	A	31	Very low	31.6	Very low	86 Å²	86	131.8 Å²	131.8	71%	0.711	78%	0.78	S	S	*	*			trans	-152.4	167	175.8	0	0	0	0	0	113.7
1172	P	41.9	Very low	31.4	Very low	127 Å²	127	137.7 Å²	137.7	83%	0.825	79%	0.79	S	S	*	*				-162.4	-174.3	92.8	44.3	-23.2	0	0	0	119.4
1173	A	25.5	Very low	29.9	Very low	92 Å²	92	136.7 Å²	136.7	76%	0.76	79%	0.786	S	S	*	*			trans	67.2	142.5	163.7	0	0	0	0	0	119.7
1174	Q	27.4	Very low	29.6	Very low	182 Å²	182	141.7 Å²	141.7	85%	0.85	79%	0.79	S	S	*	*			cis	84.5	108.8	20.4	-74.1	-165.6	-46.6	0	0	119.1
1175	Y	27	Very low	29.3	Very low	214 Å²	214	142.2 Å²	142.2	84%	0.839	79%	0.792	S	S	*	*				-169.9	172.4	118.1	-124.7	-96.8	0	0	0	113.6
1176	Q	27	Very low	28.9	Very low	172 Å²	172	138 Å²	138	80%	0.804	79%	0.785	S	S	*	*			trans	-112.9	-172.1	179.5	-64.6	-178.7	-82.7	0	0	113.2
1177	H	27.8	Very low	28.7	Very low	148 Å²	148	138.1 Å²	138.1	69%	0.685	79%	0.791	S	S	*	*			trans	98.3	144.9	168.3	-66.3	-93.7	0	0	0	117.3
1178	Q	26.4	Very low	28.5	Very low	133 Å²	133	137 Å²	137	62%	0.621	78%	0.784	S	S	*	*			cis	-166.3	163.8	-30.3	-149.9	172.2	-1.3	0	0	110.8
1179	F	26.6	Very low	28.2	Very low	191 Å²	191	144 Å²	144	84%	0.838	79%	0.791	S	S	*	*			trans	71.1	148.5	164.6	-73.7	-68	0	0	0	120.2
1180	A	28.3	Very low	28.3	Very low	92 Å²	92	141.9 Å²	141.9	76%	0.76	79%	0.787	S	S	*	*			trans	-105.9	158.4	-164.5	0	0	0	0	0	113.2
1181	T	28.3	Very low	28.6	Very low	148 Å²	148	140.2 Å²	140.2	91%	0.908	78%	0.781	S	S	*	*			trans	-131.3	164.5	152.2	33.7	0	0	0	0	110.5
1182	Q	25.4	Very low	28.7	Very low	188 Å²	188	141.9 Å²	141.9	88%	0.879	78%	0.783	S	S	*	*			trans	-91.2	175	-162	-64.2	179.6	-13.6	0	0	114.5
1183	S	24.8	Very low	28.1	Very low	103 Å²	103	143.2 Å²	143.2	72%	0.72	78%	0.782	S	S	*	*			trans	-45	177.5	170.6	-43.8	0	0	0	0	117.8
1184	Y	26	Very low	28.3	Very low	211 Å²	211	148.2 Å²	148.2	83%	0.827	78%	0.782	S	S	*	*			trans	84.7	125.6	-178.6	-68.1	-90.3	0	0	0	113.6
1185	I	29.1	Very low	28.4	Very low	159 Å²	159	145.4 Å²	145.4	82%	0.815	78%	0.778	S	S	*	*			cis	65.7	94.7	38.8	-50.3	175.4	0	0	0	112.2
1186	G	25.2	Very low	28.4	Very low	64 Å²	64	138.9 Å²	138.9	66%	0.66	78%	0.775	S	S	*	*			trans	175	122.5	166.6	0	0	0	0	0	117.1
1187	S	27.8	Very low	28.5	Very low	125 Å²	125	141.7 Å²	141.7	87%	0.874	78%	0.78	S	S	*	*			trans	69	157.8	162.3	80.7	0	0	0	0	117.2
1188	S	27.2	Very low	29.3	Very low	97 Å²	97	139.6 Å²	139.6	68%	0.678	78%	0.779	S	S	*	*			cis	-132.4	139.2	11.7	76.3	0	0	0	0	112.2
1189	R	30.6	Very low	29.3	Very low	237 Å²	237	140.3 Å²	140.3	89%	0.894	79%	0.787	S	S	*	*				58.2	132.9	102.6	-62.9	-179.2	170.9	172.8	-3.1	114.4
1190	G	32.9	Very low	29.4	Very low	71 Å²	71	136 Å²	136	73%	0.732	78%	0.78	S	S	*	*			cis	168.9	177.8	1.9	0	0	0	0	0	110.9
1191	S	34.5	Very low	30.5	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	78%	0.775	S	S	*	*			cis	-160.9	159.6	-1.1	-79.1	0	0	0	0	109.2
1192	T	32.7	Very low	30.6	Very low	121 Å²	121	133 Å²	133	74%	0.742	75%	0.754	S	S	*	*			cis	-113	-103.6	-1.4	-43.6	0	0	0	0	110.4
1193	I	30.5	Very low	30.7	Very low	156 Å²	156	128.9 Å²	128.9	80%	0.8	73%	0.733	S	S	*	*			cis	-144.2	-169.2	-14.7	-153.1	164.8	0	0	0	109.6
1194	Y	28.5	Very low	31.2	Very low	197 Å²	197	130.6 Å²	130.6	77%	0.773	73%	0.733	S	S	*	*			trans	-130.4	163.3	-158.4	-95.1	-127.8	0	0	0	111
1195	T	29	Very low	31.4	Very low	123 Å²	123	124.5 Å²	124.5	76%	0.755	72%	0.722	S	S	*	*			cis	-177.5	153.3	-26.6	32.6	0	0	0	0	106
1196	G	27.4	Very low	31.3	Very low	76 Å²	76	126 Å²	126	78%	0.784	73%	0.725	S	S	*	*			trans	155.1	92.5	159.3	0	0	0	0	0	118.1
1197	Y	30	Very low	31.5	Very low	232 Å²	232	133.4 Å²	133.4	91%	0.91	74%	0.735	S	S	*	*			trans	-82.8	171.3	148.5	-91.7	-99.2	0	0	0	109.2
1198	P	45	Very low	31.4	Very low	103 Å²	103	132.3 Å²	132.3	67%	0.669	73%	0.727	S	S	*	*			cis	-128	-176.3	-0.2	40.6	-25.3	0	0	0	113.7
1199	L	24.8	Very low	31.4	Very low	149 Å²	149	138.3 Å²	138.3	78%	0.78	74%	0.736	S	S	*	*				179.5	153.9	121.6	-98.1	168.6	0	0	0	112.9
1200	S	29.6	Very low	31.5	Very low	100 Å²	100	138 Å²	138	70%	0.699	75%	0.751	S	S	*	*			trans	-159.3	169.7	175	72.1	0	0	0	0	109.1
1201	P	50.5	Low	31.5	Very low	101 Å²	101	141.4 Å²	141.4	66%	0.656	75%	0.752	S	S	*	*			cis	-135.6	-171.7	-33.6	25.2	-2.1	0	0	0	113.5
1202	T	31.5	Very low	31.3	Very low	75 Å²	75	143.4 Å²	143.4	46%	0.46	75%	0.754	S	S	.	*			trans	98.3	144.5	150.5	80.1	0	0	0	0	123.1	K844 K845	K844-T1202 VanDerWaalsContact O-O 3.1Å; K844-T1202 PolarHBondContact O-OG1 3.33Å; K845-T1202 WeakPolarHBondContact CA-O 3.43Å
1203	K	28.1	Very low	31.2	Very low	102 Å²	102	144.6 Å²	144.6	44%	0.443	75%	0.754	S	S	.	*			trans	56.2	110.3	142.9	-73.6	160.4	-179.8	170.4	0	122.1	P842 S843 K845	P842-K1203 PolarHBondContact O-NZ 2.66Å; S843-K1203 WeakPolarHBondContact O-CD 3.01Å; S843-K1203 PolarHBondContact O-NZ 3.3Å; K845-K1203 WeakPolarHBondContact CA-O 3.41Å; K845-K1203 WeakPolarHBondContact CB-O 3.43Å; K845-K1203 WeakPolarHBondContact CG-O 3.06Å; K845-K1203 PolarHBondContact N-O 2.74Å
1204	I	35.2	Very low	31.3	Very low	139 Å²	139	143.9 Å²	143.9	71%	0.713	75%	0.752	S	S	*	*				34.6	129	95.4	-65.6	164.2	0	0	0	115.2
1205	S	28.4	Very low	31.4	Very low	84 Å²	84	140.6 Å²	140.6	59%	0.587	75%	0.75	S	S	*	*			cis	-153.7	163.8	40.7	49.6	0	0	0	0	113.5
1206	Q	27.1	Very low	31.6	Very low	190 Å²	190	141.8 Å²	141.8	89%	0.888	75%	0.75	S	S	*	*				-170.6	158.1	111.7	-103.8	175.2	-36.2	0	0	111
1207	Y	30.4	Very low	31.9	Very low	220 Å²	220	146.5 Å²	146.5	86%	0.863	75%	0.748	S	S	*	*			trans	-84.4	159.4	-172.7	-71.8	-98.3	0	0	0	113
1208	S	25	Very low	32.1	Very low	102 Å²	102	139.9 Å²	139.9	71%	0.713	74%	0.735	S	S	*	*				-174.3	139.8	114.1	-81.2	0	0	0	0	111.6
1209	Y	27.3	Very low	31	Very low	222 Å²	222	143 Å²	143	87%	0.871	74%	0.741	S	S	*	*			trans	19	133.2	158.8	-58.5	-88.8	0	0	0	119.1
1210	L	34	Very low	31.6	Very low	232 Å²	232	142.5 Å²	142.5	100%	1.215	74%	0.737	S	S	*	*			cis	-148.5	0	34.8	-133	163.4	0	0	0	111.9

Retrieved 1,210 of 1,210 residues in 300.2 ms (Link to these results)

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