A0A3Q0KKQ8_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A3Q0KKQ8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,039 aa.

						>A0A3Q0KKQ8_SCHMA|A0A3Q0KKQ8
MTGSTNIKSEGLWARSLVCTCNDNSHCVKPNYRSNKKRRSIGNCTVYSDGRCYAARVINLEALGRYLRSQVGSSAGSPINSPPSVSINPGNLNKFIRLVYGCFDSHDKTTLACNSHLTKHAVPQAIECCNSSNMCNAHLFPRFIHHETDLDAVRTALEHFGKTGLWREESIASGNIRLRPYMNVGPDMLIGGSALGNPPHNKVRMHKLWKDRVSSEDRMQNLFQIVLIATFSLVFVVLSLVFTTVCCAYKRRKQMTKLRLSTMNDKESSIMKLPGAETGCDSKSLHRFSNRDLKTMHSTSAKFEKLYKTKDGSSPHTLLTDLTHNFGSGTVTYRASDNLLSQNKFLHLIPQTVGRQITLENLLGTGRFSDVWSGTWRGEKVVAKLFRPNNRIICNIWHRTVLLHRSVLLRHQRVHGLMAVDWLNYPMEMHLSILKRYFSEPPLTVSSPCALLVGEACAYGTLKDFLSNGDWNTDFPSYLDDNAKLKNFDVTSGQNCPYSRANNADGIRLRILLEITNSLVQGLCFLHSEFAGTRGKPALAHRDLKPSNIYVRSDWSCCIGDIGLSVRLPPCPFPFSVDRLHKLYQYYTDYTEKYLHLKNYTSENLKPSERVDIFPFESQSLDTTKINLLKETTRGDQSNEPYSQTSGLLDKWNFDKLELLEWWPIGGIQIGTPRYMAPELLSKSINPFCFESYQKSDIYALALILWEVVNWALPKSIWPGQDFPDVNSIPNDCSLSRRRSSVDSMSLTYSDSSFISKSQDNKYSPVYQNEWINFTKCSMNNISRYNMRSNCNSNSKLCQDTSLCNCTPESLAESKRINTIYSSQCIVNGISLDEQLKNKEPDLGTMYYLVCKQQLRPRIPTSFPINITNETKIIDDYSHQNIQSFCEILTKDIVQLHNNVNNNNTMDIFHVNNKLTSAICREYSSSGASSLQSHHTDLNSNSKEPPPDPNKLRIIMLQYLIAGHFAMLLPECWTTEPDSRLSALRIKKRLQSIYELFNKFMNKSEEFTNITGNIMNENSNYSKANLICTNDVSTLVNRT
					

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	34	Very low	28.2	Very low	238 Å²	238	134.5 Å²	134.5	100%	1.172	79%	0.79	S	S	*	*				0	135.3	0	-77.9	171	158.3	0	0	108.2
2	T	32.3	Very low	28.1	Very low	146 Å²	146	136.3 Å²	136.3	90%	0.896	79%	0.792	S	S	*	*			trans	21.1	129	160.2	56.2	0	0	0	0	119.1
3	G	28.6	Very low	28	Very low	77 Å²	77	141.2 Å²	141.2	79%	0.794	79%	0.79	S	S	*	*			cis	166.6	152.4	8.9	0	0	0	0	0	108.7
4	S	24	Very low	27.9	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	80%	0.797	S	S	*	*			trans	-90.8	174.1	-168.6	49.7	0	0	0	0	114.2
5	T	26.5	Very low	27.9	Very low	111 Å²	111	142.6 Å²	142.6	68%	0.681	79%	0.793	S	S	*	*			trans	101.4	140.9	148.6	76.7	0	0	0	0	119.7
6	N	28.6	Very low	27.8	Very low	135 Å²	135	139.9 Å²	139.9	72%	0.722	79%	0.787	S	S	*	*			trans	72.1	151.3	142.3	-66.2	-12	0	0	0	119
7	I	28.2	Very low	27.6	Very low	125 Å²	125	142.1 Å²	142.1	64%	0.641	80%	0.796	S	S	*	*			cis	-160	144	-16.7	-112.9	163.5	0	0	0	106.7
8	K	25.9	Very low	27.5	Very low	187 Å²	187	140 Å²	140	81%	0.813	79%	0.786	S	S	*	*			trans	38	165.4	152.9	-61.2	179.4	177.8	178.3	0	123.2
9	S	27.2	Very low	27.4	Very low	95 Å²	95	138.6 Å²	138.6	66%	0.664	79%	0.786	S	S	*	*			trans	74	112.2	152.8	43.9	0	0	0	0	120.3
10	E	26.3	Very low	27.3	Very low	196 Å²	196	137.5 Å²	137.5	92%	0.916	78%	0.782	S	S	*	*			trans	74	153.7	130.9	-63.4	172	-166.4	0	0	119.5
11	G	28.8	Very low	27.3	Very low	64 Å²	64	136.4 Å²	136.4	66%	0.66	78%	0.782	S	S	*	*			trans	115	77	168.2	0	0	0	0	0	116.5
12	L	26.6	Very low	27	Very low	156 Å²	156	129.5 Å²	129.5	82%	0.817	75%	0.749	S	S	*	*			trans	28.7	106.3	131.8	-78.3	99	0	0	0	118.9
13	W	26.9	Very low	26.9	Very low	200 Å²	200	127 Å²	127	76%	0.758	73%	0.731	S	S	*	*				178.7	77.7	116.4	-88	6.5	0	0	0	111.6	R15	W13-R15 VanDerWaalsContact C-N 3.31Å; W13-R15 PolarHBondContact O-N 3.14Å
14	A	27.2	Very low	26.9	Very low	108 Å²	108	126 Å²	126	89%	0.893	71%	0.707	S	S	*	*			trans	-71.3	84	167.1	0	0	0	0	0	110.4	S16	A14-S16 PolarHBondContact O-N 3.16Å
15	R	27.6	Very low	27.1	Very low	196 Å²	196	126.8 Å²	126.8	74%	0.74	71%	0.713	S	S	*	*			trans	-80.3	98.3	171.5	-74.3	-172.4	177.4	-176.8	0.2	109.8	W13 L17	W13-R15 VanDerWaalsContact C-N 3.31Å; W13-R15 PolarHBondContact O-N 3.14Å; R15-L17 PolarHBondContact O-N 3.07Å
16	S	25.5	Very low	27.3	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	70%	0.704	S	S	*	*			trans	-59.1	118	177.6	40.1	0	0	0	0	112.6	A14 V18	A14-S16 PolarHBondContact O-N 3.16Å; S16-V18 PolarHBondContact O-N 2.75Å
17	L	24.7	Very low	27.3	Very low	177 Å²	177	126.8 Å²	126.8	93%	0.927	71%	0.714	S	S	*	*			trans	-88.5	93.4	155.8	-90.9	164.4	0	0	0	107.8	R15 C19	R15-L17 PolarHBondContact O-N 3.07Å; L17-C19 PolarHBondContact O-N 3.31Å
18	V	26.2	Very low	27.3	Very low	104 Å²	104	125.6 Å²	125.6	63%	0.63	71%	0.712	S	S	*	*			trans	-71.1	109.4	178.6	-176.3	0	0	0	0	109	S16 T20	S16-V18 PolarHBondContact O-N 2.75Å; V18-T20 VanDerWaalsContact C-N 3.3Å; V18-T20 HydrophobicContact CG1-CG2 3.73Å; V18-T20 PolarHBondContact O-N 3.41Å
19	C	25.1	Very low	27.5	Very low	114 Å²	114	125.3 Å²	125.3	77%	0.77	71%	0.711	S	S	*	*			trans	-70.9	90.7	160.4	-91.8	0	0	0	0	108.9	L17 C21	L17-C19 PolarHBondContact O-N 3.31Å; C19-C21 PolarHBondContact O-N 3.07Å
20	T	26.3	Very low	27.7	Very low	116 Å²	116	126.3 Å²	126.3	71%	0.712	72%	0.715	S	S	*	*			trans	-72.1	96.4	167.5	51.6	0	0	0	0	109.2	V18 N22	V18-T20 VanDerWaalsContact C-N 3.3Å; V18-T20 HydrophobicContact CG1-CG2 3.73Å; V18-T20 PolarHBondContact O-N 3.41Å; T20-N22 VanDerWaalsContact C-N 3.3Å; T20-N22 PolarHBondContact O-N 3.12Å
21	C	26	Very low	27.9	Very low	115 Å²	115	122.1 Å²	122.1	78%	0.777	70%	0.699	S	S	*	*			trans	-65.7	89.9	166.7	-66.1	0	0	0	0	109.8	C19	C19-C21 PolarHBondContact O-N 3.07Å
22	N	28.5	Very low	27.9	Very low	92 Å²	92	129.4 Å²	129.4	49%	0.492	71%	0.708	S	S	.	*			trans	-73.2	151.5	162.1	-170.6	17.2	0	0	0	109.4	T20 N24	T20-N22 VanDerWaalsContact C-N 3.3Å; T20-N22 PolarHBondContact O-N 3.12Å; N22-N24 PolarHBondContact O-N 3.26Å; N22-N24 VanDerWaalsContact O-N 3.08Å
23	D	29.6	Very low	28.1	Very low	94 Å²	94	133.4 Å²	133.4	50%	0.503	71%	0.712	S	S	.	*	S	Bend	trans	-55.5	-24.3	-179	-66.7	56.9	0	0	0	114.4	R534	D23-R534 IonicContact OD1-CZ 3.59Å; D23-R534 IonicContact OD1-NE 3.41Å; D23-R534 PolarHBondContact OD1-NE 2.94Å; D23-R534 IonicContact OD1-NH2 3.55Å; D23-R534 PolarHBondContact OD1-NH2 3.38Å; D23-R534 WeakPolarHBondContact OD2-CD 2.97Å; D23-R534 IonicContact OD2-CZ 2.93Å; D23-R534 IonicContact OD2-NE 2.71Å; D23-R534 PolarHBondContact OD2-NE 3.49Å; D23-R534 IonicContact OD2-NH1 2.69Å; D23-R534 PolarHBondContact OD2-NH1 2.91Å; D23-R534 IonicContact OD2-NH2 3.48Å; D23-R534 PolarHBondContact OD2-NH2 2.96Å
24	N	29.5	Very low	28.3	Very low	57 Å²	57	129 Å²	129	31%	0.305	71%	0.712	S	S	.	*	S	Bend	trans	-91.6	120.8	176.4	-63.4	-11.6	0	0	0	108.8	N22 H26	N22-N24 PolarHBondContact O-N 3.26Å; N22-N24 VanDerWaalsContact O-N 3.08Å; N24-H26 PolarHBondContact O-N 3.39Å
25	S	28.7	Very low	28.4	Very low	121 Å²	121	131.3 Å²	131.3	85%	0.846	71%	0.709	S	S	*	*			trans	-68.4	62.7	-172.1	51.2	0	0	0	0	114.5
26	H	29.2	Very low	28.5	Very low	110 Å²	110	131.3 Å²	131.3	51%	0.509	72%	0.715	S	S	.	*			trans	-130	118.3	-178.8	-62.8	-55.3	0	0	0	111.8	N24	N24-H26 PolarHBondContact O-N 3.39Å
27	C	28.3	Very low	28.6	Very low	136 Å²	136	136.8 Å²	136.8	92%	0.919	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-87.8	120.6	160.4	-67.8	0	0	0	0	108.8
28	V	29	Very low	28.6	Very low	99 Å²	99	137.7 Å²	137.7	60%	0.6	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-101.8	125.6	179.1	-178.7	0	0	0	0	109.8	T309	V28-T309 HydrophobicContact CG2-CG2 4.23Å
29	K	31	Very low	28.3	Very low	182 Å²	182	144.3 Å²	144.3	79%	0.791	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-70.6	141.1	172.2	-85.7	-177.7	173.9	176.7	0	110.8	N31	K29-N31 PolarHBondContact O-N 3.27Å
30	P	31	Very low	28.3	Very low	116 Å²	116	144 Å²	144	75%	0.753	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-66.3	131.7	168.4	-15.3	29.4	0	0	0	110.5	Y32	P30-Y32 PolarHBondContact O-N 3.41Å
31	N	30.7	Very low	28.2	Very low	107 Å²	107	144.1 Å²	144.1	57%	0.572	73%	0.725	S	S	*	*			trans	-80.8	114	-176.3	-128.7	-60	0	0	0	110.4	K29 D311	K29-N31 PolarHBondContact O-N 3.27Å; N31-D311 PolarHBondContact ND2-OD1 2.91Å; N31-D311 PolarHBondContact ND2-OD2 2.89Å
32	Y	29.1	Very low	28.1	Very low	218 Å²	218	141.3 Å²	141.3	86%	0.855	72%	0.715	S	S	*	*			trans	-132	125.5	172.5	-103.4	-88.6	0	0	0	111.4	P30	P30-Y32 PolarHBondContact O-N 3.41Å
33	R	29.1	Very low	27.9	Very low	239 Å²	239	143.4 Å²	143.4	90%	0.902	73%	0.726	S	S	*	*			trans	-72.7	139.3	178.9	-69.4	174.1	167.1	178.4	-5.8	111.7
34	S	32.8	Very low	27.5	Very low	107 Å²	107	144.3 Å²	144.3	75%	0.748	74%	0.739	S	S	*	*				173.5	154.7	127.6	43.2	0	0	0	0	112.7
35	N	29.1	Very low	27.2	Very low	157 Å²	157	146 Å²	146	84%	0.84	75%	0.751	S	S	*	*			trans	-84.4	169.1	-171.6	-73.4	-38.6	0	0	0	114.4
36	K	30.1	Very low	27	Very low	197 Å²	197	146.5 Å²	146.5	86%	0.857	75%	0.749	S	S	*	*	S	Bend	trans	80.3	120.5	162.4	-63	178.6	178	178	0	117.7
37	K	26.4	Very low	26.7	Very low	214 Å²	214	150 Å²	150	93%	0.93	76%	0.759	S	S	*	*			trans	36.6	95	155.9	-64	-174.6	177.8	-177.7	0	117.1
38	R	25.8	Very low	26.6	Very low	197 Å²	197	147.3 Å²	147.3	74%	0.743	74%	0.741	S	S	*	*			trans	-122.8	113	163.1	-67.9	-171.6	-179.7	-164.8	0	111.6
39	R	20.1	Very low	26.3	Very low	243 Å²	243	149.2 Å²	149.2	92%	0.917	75%	0.748	S	S	*	*			trans	-78.9	148.5	146.8	-76.4	179.7	171.8	172.6	-3.7	107.1
40	S	24.4	Very low	26.1	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	75%	0.748	S	S	*	*			trans	62.4	177	173.5	77.6	0	0	0	0	116.2
41	I	24.6	Very low	25.7	Very low	120 Å²	120	148.6 Å²	148.6	62%	0.615	75%	0.749	S	S	*	*			trans	69.5	92.6	-168.4	-42.2	161.5	0	0	0	110.8
42	G	22.1	Very low	25.3	Very low	55 Å²	55	149.1 Å²	149.1	57%	0.567	76%	0.76	S	S	*	*			cis	111.6	176.5	29.2	0	0	0	0	0	109.9
43	N	25.6	Very low	25	Very low	136 Å²	136	148.4 Å²	148.4	73%	0.727	76%	0.757	S	S	*	*	S	Bend	trans	75.7	81.7	166.4	-33.9	-20	0	0	0	114.2
44	C	21.7	Very low	24.7	Very low	114 Å²	114	141.6 Å²	141.6	77%	0.77	75%	0.753	S	S	*	*			cis	-137.8	159.6	2.4	-61.3	0	0	0	0	109.4
45	T	21.9	Very low	24.2	Very low	92 Å²	92	140.9 Å²	140.9	56%	0.564	75%	0.753	S	S	*	*			cis	72.7	46.3	6.5	78.8	0	0	0	0	118.8
46	V	25.2	Very low	24	Very low	132 Å²	132	145.1 Å²	145.1	80%	0.8	76%	0.757	S	S	*	*				-122.8	97.4	127.7	-165.1	0	0	0	0	104.3
47	Y	22.9	Very low	23.9	Very low	183 Å²	183	141.6 Å²	141.6	72%	0.718	75%	0.752	S	S	*	*				53.2	110.7	84.8	-71.8	-78	0	0	0	109.8
48	S	26.5	Very low	24.1	Very low	79 Å²	79	137.8 Å²	137.8	55%	0.552	74%	0.74	S	S	*	*			cis	122	151.7	49.5	64.1	0	0	0	0	106
49	D	23	Very low	24.3	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	72%	0.723	S	S	*	*			trans	59	95	158	-28.6	-48	0	0	0	118.8
50	G	25.8	Very low	25.1	Very low	76 Å²	76	124 Å²	124	78%	0.784	70%	0.7	S	S	*	*			trans	-169.3	54.5	169.1	0	0	0	0	0	112.3
51	R	23.3	Very low	25.8	Very low	208 Å²	208	123.5 Å²	123.5	79%	0.785	69%	0.685	S	S	*	*				66	118.1	96.4	-68.7	-165.4	-178.1	-165.1	2.4	114.3
52	C	21.8	Very low	26.5	Very low	119 Å²	119	119.9 Å²	119.9	80%	0.804	67%	0.673	S	S	*	*			trans	-72.1	150.1	-177.1	-39.1	0	0	0	0	112.8
53	Y	23.9	Very low	27.3	Very low	202 Å²	202	121 Å²	121	79%	0.792	67%	0.666	S	S	*	*			trans	-138.8	149	151.7	-67.8	-70.1	0	0	0	110.9
54	A	22.4	Very low	27.9	Very low	97 Å²	97	115.3 Å²	115.3	80%	0.802	64%	0.639	S	S	*	*			trans	-117.2	150.6	-163.8	0	0	0	0	0	113.3
55	A	22.3	Very low	28.9	Very low	92 Å²	92	116.4 Å²	116.4	76%	0.76	63%	0.627	S	S	*	*			trans	41.3	129.5	148.8	0	0	0	0	0	120.3
56	R	24.2	Very low	29.8	Very low	245 Å²	245	117.8 Å²	117.8	93%	0.925	62%	0.623	S	S	*	*				-128.3	116.7	120.1	-149.4	174	-169.5	-177.3	2.7	109.6	I58	R56-I58 PolarHBondContact O-N 3.04Å; R56-I58 VanDerWaalsContact O-N 3.17Å
57	V	27.9	Very low	30.4	Very low	123 Å²	123	116.5 Å²	116.5	75%	0.745	61%	0.611	S	S	*	*			trans	-63.4	115.3	169.1	177	0	0	0	0	106.9	N59	V57-N59 PolarHBondContact O-N 2.74Å
58	I	29.8	Very low	31.5	Very low	134 Å²	134	115.6 Å²	115.6	69%	0.687	61%	0.606	S	S	*	*			trans	-68.2	98	160	-64.7	167.9	0	0	0	104.8	R56 L60	R56-I58 PolarHBondContact O-N 3.04Å; R56-I58 VanDerWaalsContact O-N 3.17Å; I58-L60 VanDerWaalsContact C-N 3.27Å; I58-L60 PolarHBondContact O-N 3.04Å
59	N	31.7	Very low	32.5	Very low	70 Å²	70	115.4 Å²	115.4	37%	0.374	61%	0.605	S	S	.	*			trans	-69.7	93.4	174	-176.9	-12.9	0	0	0	107.2	V57 E61 A62 L63	V57-N59 PolarHBondContact O-N 2.74Å; N59-E61 PolarHBondContact O-N 3.41Å; N59-E61 WeakPolarHBondContact OD1-CA 3.39Å; N59-E61 WeakPolarHBondContact OD1-CB 3.27Å; N59-E61 PolarHBondContact OD1-N 3.47Å; N59-A62 HydrophobicContact CB-CB 3.72Å; N59-A62 CarbonylContact O-C 3.35Å; N59-A62 WeakPolarHBondContact O-CA 3.36Å; N59-A62 WeakPolarHBondContact O-CB 3.47Å; N59-A62 PolarHBondContact O-N 2.86Å; N59-A62 PolarHBondContact OD1-N 3.03Å; N59-L63 PolarHBondContact O-N 2.78Å
60	L	36.1	Very low	33.4	Very low	82 Å²	82	114.7 Å²	114.7	43%	0.429	60%	0.597	S	S	.	*	H	α-helix	trans	-57.6	-26.9	175.3	-84.1	155.5	0	0	0	111.8	I58 G64 I176	I58-L60 VanDerWaalsContact C-N 3.27Å; I58-L60 PolarHBondContact O-N 3.04Å; L60-G64 WeakPolarHBondContact O-CA 3.3Å; L60-G64 PolarHBondContact O-N 3.36Å; L60-I176 HydrophobicContact CD1-CD1 4.42Å
61	E	38.4	Very low	33.9	Very low	95 Å²	95	116.2 Å²	116.2	44%	0.444	59%	0.591	S	S	.	*	H	α-helix	trans	-75	-31.2	171.7	-161	-165.2	-134.1	0	0	112	N59 R65	N59-E61 PolarHBondContact O-N 3.41Å; N59-E61 WeakPolarHBondContact OD1-CA 3.39Å; N59-E61 WeakPolarHBondContact OD1-CB 3.27Å; N59-E61 PolarHBondContact OD1-N 3.47Å; E61-R65 WeakPolarHBondContact O-CA 3.49Å; E61-R65 WeakPolarHBondContact O-CB 3.2Å; E61-R65 WeakPolarHBondContact O-CG 3.15Å; E61-R65 PolarHBondContact O-N 2.96Å; E61-R65 PolarHBondContact O-NE 3.48Å; E61-R65 IonicContact OE2-CZ 3.51Å; E61-R65 IonicContact OE2-NE 3.57Å; E61-R65 IonicContact OE2-NH2 2.67Å; E61-R65 PolarHBondContact OE2-NH2 3.46Å
62	A	40.4	Very low	34.5	Very low	43 Å²	43	109.3 Å²	109.3	36%	0.355	58%	0.584	S	S	.	*	H	α-helix	trans	-75.1	-37	171.3	0	0	0	0	0	112.1	N59 R65 Y66	N59-A62 HydrophobicContact CB-CB 3.72Å; N59-A62 CarbonylContact O-C 3.35Å; N59-A62 WeakPolarHBondContact O-CA 3.36Å; N59-A62 WeakPolarHBondContact O-CB 3.47Å; N59-A62 PolarHBondContact O-N 2.86Å; N59-A62 PolarHBondContact OD1-N 3.03Å; A62-R65 PolarHBondContact O-N 3.28Å; A62-Y66 VanDerWaalsContact O-CB 3.3Å; A62-Y66 WeakPolarHBondContact O-CB 3.22Å; A62-Y66 PolarHBondContact O-N 3.48Å
63	L	37.9	Very low	35.1	Very low	78 Å²	78	109.7 Å²	109.7	41%	0.408	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-45.1	169.9	-176.2	62.9	0	0	0	110.2	N59 R65 Y66 L67	N59-L63 PolarHBondContact O-N 2.78Å; L63-R65 PolarHBondContact O-N 3.27Å; L63-Y66 PolarHBondContact O-N 3.06Å; L63-L67 HydrophobicContact CG-CD1 4.19Å; L63-L67 WeakPolarHBondContact O-CB 3.49Å; L63-L67 VanDerWaalsContact O-CG 3.25Å; L63-L67 WeakPolarHBondContact O-CG 3.3Å; L63-L67 PolarHBondContact O-N 3.49Å
64	G	38.1	Very low	35.6	Very low	17 Å²	17	105.4 Å²	105.4	18%	0.175	59%	0.588	C	S	.	*	H	α-helix	trans	-67	-29.8	174.1	0	0	0	0	0	113.9	L60 R68	L60-G64 WeakPolarHBondContact O-CA 3.3Å; L60-G64 PolarHBondContact O-N 3.36Å; G64-R68 VanDerWaalsContact O-CB 3.22Å; G64-R68 WeakPolarHBondContact O-CB 3.46Å; G64-R68 VanDerWaalsContact O-CG 3.3Å; G64-R68 WeakPolarHBondContact O-CG 3.49Å; G64-R68 PolarHBondContact O-N 3.21Å; G64-R68 PolarHBondContact O-NE 3.14Å
65	R	43.2	Very low	36.2	Very low	137 Å²	137	105.9 Å²	105.9	52%	0.517	59%	0.592	S	S	.	*	H	α-helix	trans	-76.2	-34.5	171.1	-83.1	-176	-89.5	151.4	-15.2	111.9	E61 A62 L63 R68 S69	E61-R65 WeakPolarHBondContact O-CA 3.49Å; E61-R65 WeakPolarHBondContact O-CB 3.2Å; E61-R65 WeakPolarHBondContact O-CG 3.15Å; E61-R65 PolarHBondContact O-N 2.96Å; E61-R65 PolarHBondContact O-NE 3.48Å; E61-R65 IonicContact OE2-CZ 3.51Å; E61-R65 IonicContact OE2-NE 3.57Å; E61-R65 IonicContact OE2-NH2 2.67Å; E61-R65 PolarHBondContact OE2-NH2 3.46Å; A62-R65 PolarHBondContact O-N 3.28Å; L63-R65 PolarHBondContact O-N 3.27Å; R65-R68 CarbonylContact O-C 3.29Å; R65-R68 PolarHBondContact O-N 3.5Å; R65-S69 VanDerWaalsContact O-CB 3.27Å; R65-S69 WeakPolarHBondContact O-CB 3.4Å; R65-S69 PolarHBondContact O-N 3.33Å; R65-S69 PolarHBondContact O-OG 3.08Å
66	Y	41.1	Very low	36.6	Very low	122 Å²	122	105 Å²	105	48%	0.478	59%	0.593	S	S	.	*	H	α-helix	trans	-66.1	-49.3	172.7	-179.9	-103.1	0	0	0	110.8	A62 L63 R68 S69 Q70	A62-Y66 VanDerWaalsContact O-CB 3.3Å; A62-Y66 WeakPolarHBondContact O-CB 3.22Å; A62-Y66 PolarHBondContact O-N 3.48Å; L63-Y66 PolarHBondContact O-N 3.06Å; Y66-R68 VanDerWaalsContact C-N 3.33Å; Y66-R68 PolarHBondContact O-N 2.99Å; Y66-S69 WeakPolarHBondContact CA-OG 3.39Å; Y66-S69 PolarHBondContact O-N 3.31Å; Y66-S69 PolarHBondContact O-OG 3.28Å; Y66-Q70 HydrophobicContact CE1-CG 4.45Å; Y66-Q70 WeakPolarHBondContact O-CG 3.25Å; Y66-Q70 PolarHBondContact O-N 3.24Å
67	L	38.7	Very low	36.9	Very low	105 Å²	105	98.4 Å²	98.4	55%	0.55	58%	0.583	S	S	.	*	H	α-helix	trans	-59.3	-41.6	173.9	-68.4	168.9	0	0	0	111.4	L63 Q70 V71	L63-L67 HydrophobicContact CG-CD1 4.19Å; L63-L67 WeakPolarHBondContact O-CB 3.49Å; L63-L67 VanDerWaalsContact O-CG 3.25Å; L63-L67 WeakPolarHBondContact O-CG 3.3Å; L63-L67 PolarHBondContact O-N 3.49Å; L67-Q70 PolarHBondContact O-N 3.32Å; L67-V71 WeakPolarHBondContact O-CG2 3.4Å; L67-V71 PolarHBondContact O-N 3.17Å
68	R	45.6	Very low	36.9	Very low	164 Å²	164	98.5 Å²	98.5	62%	0.619	59%	0.587	S	S	*	*	H	α-helix	trans	-71.3	-24.5	172.1	-78.2	179.5	-79.7	-128.4	4.6	114.5	G64 R65 Y66 V71	G64-R68 VanDerWaalsContact O-CB 3.22Å; G64-R68 WeakPolarHBondContact O-CB 3.46Å; G64-R68 VanDerWaalsContact O-CG 3.3Å; G64-R68 WeakPolarHBondContact O-CG 3.49Å; G64-R68 PolarHBondContact O-N 3.21Å; G64-R68 PolarHBondContact O-NE 3.14Å; R65-R68 CarbonylContact O-C 3.29Å; R65-R68 PolarHBondContact O-N 3.5Å; Y66-R68 VanDerWaalsContact C-N 3.33Å; Y66-R68 PolarHBondContact O-N 2.99Å; R68-V71 CarbonylContact O-C 3.51Å; R68-V71 VanDerWaalsContact O-C 3.29Å; R68-V71 PolarHBondContact O-N 2.86Å
69	S	46.3	Very low	36.9	Very low	75 Å²	75	98.7 Å²	98.7	52%	0.524	59%	0.588	S	S	.	*	H	α-helix	trans	-77.9	-24.7	175.3	67.9	0	0	0	0	113	R65 Y66 V71	R65-S69 VanDerWaalsContact O-CB 3.27Å; R65-S69 WeakPolarHBondContact O-CB 3.4Å; R65-S69 PolarHBondContact O-N 3.33Å; R65-S69 PolarHBondContact O-OG 3.08Å; Y66-S69 WeakPolarHBondContact CA-OG 3.39Å; Y66-S69 PolarHBondContact O-N 3.31Å; Y66-S69 PolarHBondContact O-OG 3.28Å; S69-V71 VanDerWaalsContact C-N 3.34Å
70	Q	41.8	Very low	36.8	Very low	125 Å²	125	102 Å²	102	58%	0.584	61%	0.605	S	S	*	*	H	α-helix	trans	-78.1	-22.7	169.2	-62.7	-63.1	-33.8	0	0	111.6	Y66 L67 G72	Y66-Q70 HydrophobicContact CE1-CG 4.45Å; Y66-Q70 WeakPolarHBondContact O-CG 3.25Å; Y66-Q70 PolarHBondContact O-N 3.24Å; L67-Q70 PolarHBondContact O-N 3.32Å; Q70-G72 PolarHBondContact O-N 3.38Å
71	V	37.7	Very low	36.6	Very low	107 Å²	107	103.4 Å²	103.4	65%	0.648	62%	0.622	S	S	*	*	S	Bend	trans	-96.4	71.1	169.9	-174.4	0	0	0	0	109.2	L67 R68 S69 S73	L67-V71 WeakPolarHBondContact O-CG2 3.4Å; L67-V71 PolarHBondContact O-N 3.17Å; R68-V71 CarbonylContact O-C 3.51Å; R68-V71 VanDerWaalsContact O-C 3.29Å; R68-V71 PolarHBondContact O-N 2.86Å; S69-V71 VanDerWaalsContact C-N 3.34Å; V71-S73 PolarHBondContact O-N 2.89Å; V71-S73 VanDerWaalsContact O-N 3.07Å
72	G	34.6	Very low	36.3	Very low	63 Å²	63	104.6 Å²	104.6	65%	0.649	64%	0.638	S	S	*	*			trans	-50.8	114.4	-178.9	0	0	0	0	0	112.2	Q70 S74	Q70-G72 PolarHBondContact O-N 3.38Å; G72-S74 PolarHBondContact O-N 2.93Å; G72-S74 VanDerWaalsContact O-N 3.12Å
73	S	34.5	Very low	35.9	Very low	127 Å²	127	108 Å²	108	89%	0.888	66%	0.657	S	S	*	*			trans	-78.5	94.4	178.5	-64.3	0	0	0	0	110.6	V71	V71-S73 PolarHBondContact O-N 2.89Å; V71-S73 VanDerWaalsContact O-N 3.07Å
74	S	35.6	Very low	35.5	Very low	112 Å²	112	110.1 Å²	110.1	78%	0.783	68%	0.678	S	S	*	*			trans	-109.2	126.2	154.5	55.1	0	0	0	0	108.6	G72	G72-S74 PolarHBondContact O-N 2.93Å; G72-S74 VanDerWaalsContact O-N 3.12Å
75	A	34.5	Very low	35.1	Very low	107 Å²	107	114.8 Å²	114.8	88%	0.884	70%	0.703	S	S	*	*			trans	-66.4	150.1	-171.5	0	0	0	0	0	113.5
76	G	30.6	Very low	34.5	Very low	75 Å²	75	114 Å²	114	77%	0.773	72%	0.718	S	S	*	*			trans	83.6	80.7	151.9	0	0	0	0	0	118.1
77	S	30	Very low	34	Very low	105 Å²	105	114.2 Å²	114.2	73%	0.734	73%	0.726	S	S	*	*			trans	-177.5	132	139.5	52.2	0	0	0	0	111.3
78	P	28.9	Very low	33.9	Very low	126 Å²	126	116.6 Å²	116.6	82%	0.818	74%	0.74	S	S	*	*			trans	-99.4	88.9	175.7	35.9	-29.2	0	0	0	111.7
79	I	29.3	Very low	33.2	Very low	138 Å²	138	113.5 Å²	113.5	71%	0.708	74%	0.741	S	S	*	*			trans	-139.9	132.3	165.7	-78.2	101.5	0	0	0	111
80	N	30.8	Very low	32.5	Very low	139 Å²	139	112.6 Å²	112.6	74%	0.743	74%	0.744	S	S	*	*	S	Bend	trans	-1.8	129.3	156	-52	-31.7	0	0	0	119.4
81	S	29.9	Very low	32.2	Very low	111 Å²	111	114.5 Å²	114.5	78%	0.776	76%	0.757	S	S	*	*			trans	48.2	93.2	153.6	59.3	0	0	0	0	119
82	P	33.6	Very low	32.2	Very low	120 Å²	120	114 Å²	114	78%	0.779	75%	0.751	S	S	*	*			trans	-95.6	164.4	161.5	8.9	11.8	0	0	0	112.8
83	P	31.3	Very low	32.2	Very low	115 Å²	115	117.9 Å²	117.9	75%	0.747	76%	0.757	S	S	*	*			trans	-97.4	-179.5	-145.5	-4.1	24.9	0	0	0	115.9	V85	P83-V85 PolarHBondContact O-N 3.23Å
84	S	28.7	Very low	32.2	Very low	122 Å²	122	116.5 Å²	116.5	85%	0.853	74%	0.735	S	S	*	*			trans	-52.6	105.5	172.9	49.9	0	0	0	0	113.3
85	V	30.3	Very low	32.1	Very low	116 Å²	116	116 Å²	116	70%	0.703	72%	0.719	S	S	*	*			trans	-85.2	117	172.7	-180	0	0	0	0	110.2	P83 I87	P83-V85 PolarHBondContact O-N 3.23Å; V85-I87 HydrophobicContact CG1-CG1 4.11Å; V85-I87 PolarHBondContact O-N 2.8Å; V85-I87 VanDerWaalsContact O-N 3.16Å
86	S	29.9	Very low	32.1	Very low	119 Å²	119	113.7 Å²	113.7	83%	0.832	69%	0.691	S	S	*	*			trans	-75.6	96	172.3	57.6	0	0	0	0	110.9
87	I	31.8	Very low	32	Very low	128 Å²	128	114.2 Å²	114.2	66%	0.656	67%	0.669	S	S	*	*			trans	-80.6	122.8	176.3	-59.6	177.5	0	0	0	109.6	V85 P89	V85-I87 HydrophobicContact CG1-CG1 4.11Å; V85-I87 PolarHBondContact O-N 2.8Å; V85-I87 VanDerWaalsContact O-N 3.16Å; I87-P89 WeakPolarHBondContact O-CD 3.49Å
88	N	36.1	Very low	32	Very low	155 Å²	155	113.9 Å²	113.9	83%	0.829	66%	0.659	S	S	*	*			trans	-79.1	111.9	179.6	-154.1	-8.5	0	0	0	109.5	G90	N88-G90 PolarHBondContact O-N 3.48Å
89	P	31.4	Very low	32	Very low	98 Å²	98	112.9 Å²	112.9	64%	0.636	65%	0.65	S	S	*	*			trans	-85.5	89.1	-161.6	32.8	-34.6	0	0	0	112.2	I87	I87-P89 WeakPolarHBondContact O-CD 3.49Å
90	G	31.1	Very low	32	Very low	57 Å²	57	115.2 Å²	115.2	59%	0.588	65%	0.651	S	S	*	*			trans	-125.7	127.8	173.2	0	0	0	0	0	112.7	N88	N88-G90 PolarHBondContact O-N 3.48Å
91	N	35.8	Very low	31.9	Very low	164 Å²	164	110.8 Å²	110.8	88%	0.877	64%	0.639	S	S	*	*	S	Bend	trans	74	14.3	166.4	-63.8	-23	0	0	0	120.4
92	L	36.8	Very low	31.8	Very low	98 Å²	98	111.7 Å²	111.7	51%	0.513	64%	0.644	S	S	.	*			trans	-84.7	114.2	153.1	-104.4	74.8	0	0	0	109.7	K94	L92-K94 PolarHBondContact O-N 2.67Å; L92-K94 VanDerWaalsContact O-N 3.17Å
93	N	35.6	Very low	31.6	Very low	143 Å²	143	110.6 Å²	110.6	77%	0.765	63%	0.627	S	S	*	*			trans	-63.6	115.7	177.5	-81.3	-22.4	0	0	0	109.8	F95	N93-F95 HydrophobicContact CB-CD2 4.32Å; N93-F95 PolarHBondContact O-N 2.97Å
94	K	34	Very low	31.5	Very low	98 Å²	98	108.2 Å²	108.2	43%	0.426	61%	0.608	S	S	.	*			trans	-73.1	46.3	-175.1	-63.8	-165.7	169.2	-160	0	114.1	L92	L92-K94 PolarHBondContact O-N 2.67Å; L92-K94 VanDerWaalsContact O-N 3.17Å
95	F	33.5	Very low	31.9	Very low	102 Å²	102	107.5 Å²	107.5	45%	0.447	60%	0.602	S	S	.	*			trans	-136.6	96.6	-171	-60	-57.9	0	0	0	111.5	N93 F143	N93-F95 HydrophobicContact CB-CD2 4.32Å; N93-F95 PolarHBondContact O-N 2.97Å; F95-F143 HydrophobicContact CB-CD1 4.37Å; F95-F143 HydrophobicContact CD1-CB 3.81Å; F95-F143 AromaticContact CD1-CD1 3.24Å; F95-F143 HydrophobicContact CD1-CD1 3.24Å; F95-F143 AromaticContact CD1-CE1 3.96Å; F95-F143 HydrophobicContact CD1-CE1 3.96Å; F95-F143 AromaticContact CD1-CG 3.64Å; F95-F143 HydrophobicContact CD1-CG 3.64Å; F95-F143 HydrophobicContact CE1-CB 3.83Å; F95-F143 AromaticContact CE1-CD1 3.66Å; F95-F143 HydrophobicContact CE1-CD1 3.66Å; F95-F143 HydrophobicContact CE1-CD2 4.27Å; F95-F143 HydrophobicContact CE1-CE1 4.29Å; F95-F143 AromaticContact CE1-CG 3.64Å; F95-F143 HydrophobicContact CE1-CG 3.64Å; F95-F143 AromaticContact CG-CD1 3.98Å; F95-F143 HydrophobicContact CG-CD1 3.98Å; F95-F143 HydrophobicContact CG-CE1 4.35Å
96	I	35.4	Very low	32.1	Very low	58 Å²	58	109.6 Å²	109.6	30%	0.297	60%	0.604	S	S	.	*			trans	-108.8	108.6	153.5	-60.2	176.7	0	0	0	106.5	A152 A156	I96-A152 HydrophobicContact CD1-CB 4.24Å; I96-A152 WeakPolarHBondContact CD1-O 3.19Å; I96-A156 HydrophobicContact CD1-CB 3.91Å
97	R	27.7	Very low	32.2	Very low	87 Å²	87	109.5 Å²	109.5	33%	0.328	60%	0.595	S	S	.	*			trans	-148.4	122	158.5	-150	178.9	-164.2	127.3	4.4	110.1	R142 F143 I144	R97-R142 WeakPolarHBondContact CD-O 3.46Å; R97-R142 VanDerWaalsContact NH1-CB 3.35Å; R97-R142 PolarHBondContact NH1-O 3.03Å; R97-F143 PolarHBondContact NH1-O 3.05Å; R97-I144 HydrophobicContact CG-CD1 4.27Å; R97-I144 HydrophobicContact CG-CG1 4.13Å; R97-I144 VanDerWaalsContact CZ-CG1 3.46Å
98	L	31.1	Very low	32.2	Very low	97 Å²	97	113.3 Å²	113.3	51%	0.508	61%	0.606	S	S	.	*			trans	-82.3	123.5	172.7	-71.1	161.5	0	0	0	108.7	Y100	L98-Y100 HydrophobicContact CB-CE2 3.91Å; L98-Y100 HydrophobicContact CD1-CE2 4.45Å
99	V	28.3	Very low	31.9	Very low	106 Å²	106	109.3 Å²	109.3	64%	0.642	59%	0.587	S	S	*	*			trans	-118.2	129.8	165.6	-177.6	0	0	0	0	105.6
100	Y	29.1	Very low	31.7	Very low	187 Å²	187	110.8 Å²	110.8	73%	0.733	60%	0.595	S	S	*	*			trans	-112.1	137.8	-177	-74.2	-69.8	0	0	0	112.5	L98	L98-Y100 HydrophobicContact CB-CE2 3.91Å; L98-Y100 HydrophobicContact CD1-CE2 4.45Å
101	G	28.5	Very low	31.6	Very low	46 Å²	46	113.2 Å²	113.2	47%	0.474	59%	0.594	S	S	.	*			trans	-164.3	163.5	171.9	0	0	0	0	0	112
102	C	28	Very low	31.3	Very low	130 Å²	130	108.8 Å²	108.8	88%	0.878	58%	0.58	S	S	*	*			trans	65.6	153	162.6	-66.5	0	0	0	0	121.5	N183	C102-N183 PolarHBondContact O-ND2 2.73Å
103	F	29.1	Very low	31	Very low	97 Å²	97	108.1 Å²	108.1	43%	0.425	58%	0.583	S	S	.	*			trans	-89.1	148	-155.6	-126.7	-85.9	0	0	0	114.7	D107 T109 L111 N183	F103-D107 WeakPolarHBondContact CE1-O 3.36Å; F103-T109 WeakPolarHBondContact CZ-O 3.34Å; F103-T109 WeakPolarHBondContact CZ-OG1 3.41Å; F103-L111 HydrophobicContact CE2-CB 3.93Å; F103-L111 HydrophobicContact CE2-CD1 3.69Å; F103-L111 HydrophobicContact CE2-CG 3.91Å; F103-L111 HydrophobicContact CZ-CB 4.21Å; F103-L111 HydrophobicContact CZ-CD1 3.56Å; F103-L111 HydrophobicContact CZ-CG 3.7Å; F103-N183 PolarHBondContact O-ND2 3.07Å
104	D	30.3	Very low	30.8	Very low	65 Å²	65	104.4 Å²	104.4	35%	0.348	56%	0.563	S	S	.	*			trans	-61	139	164	-173.2	-21.4	0	0	0	109.6	H106 N183	D104-H106 PolarHBondContact O-N 3.11Å; D104-H106 IonicContact OD1-CD2 3.78Å; D104-H106 PolarHBondContact OD1-N 2.96Å; D104-H106 VanDerWaalsContact OD1-N 3.17Å; D104-N183 PolarHBondContact N-ND2 2.93Å
105	S	35.9	Very low	30.9	Very low	106 Å²	106	101.4 Å²	101.4	74%	0.741	55%	0.554	S	S	*	*	S	Bend	trans	-69	-10.7	-176.9	52.8	0	0	0	0	114.5
106	H	34.6	Very low	31.2	Very low	160 Å²	160	100.7 Å²	100.7	74%	0.741	55%	0.552	S	S	*	*	S	Bend	trans	-99.6	-27.1	-170.7	-80.9	-70.9	0	0	0	117.5	D104	D104-H106 PolarHBondContact O-N 3.11Å; D104-H106 IonicContact OD1-CD2 3.78Å; D104-H106 PolarHBondContact OD1-N 2.96Å; D104-H106 VanDerWaalsContact OD1-N 3.17Å
107	D	33.2	Very low	31.4	Very low	118 Å²	118	100.5 Å²	100.5	63%	0.631	55%	0.551	S	S	*	*			trans	-112.4	111.2	-174.3	-91.2	-33.7	0	0	0	114.4	F103 T109	F103-D107 WeakPolarHBondContact CE1-O 3.36Å; D107-T109 PolarHBondContact O-N 2.65Å
108	K	30	Very low	31.7	Very low	207 Å²	207	100.6 Å²	100.6	90%	0.9	56%	0.561	S	S	*	*			trans	-73	65.5	178.4	-64.1	177.6	-178.9	172.8	0	112.7
109	T	29.8	Very low	31.8	Very low	71 Å²	71	103 Å²	103	44%	0.436	57%	0.568	S	S	.	*			trans	-109.2	131.7	172.9	57	0	0	0	0	111.5	F103 D107 L111	F103-T109 WeakPolarHBondContact CZ-O 3.34Å; F103-T109 WeakPolarHBondContact CZ-OG1 3.41Å; D107-T109 PolarHBondContact O-N 2.65Å; T109-L111 PolarHBondContact O-N 3.41Å
110	T	27.8	Very low	32.1	Very low	130 Å²	130	102.3 Å²	102.3	80%	0.798	56%	0.557	S	S	*	*			trans	-80.2	92.7	171.7	47.7	0	0	0	0	109.4
111	L	28.9	Very low	32.4	Very low	107 Å²	107	98.8 Å²	98.8	56%	0.56	57%	0.567	S	S	*	*			trans	-79.5	124.2	173	-70.3	173.2	0	0	0	111.2	F103 T109	F103-L111 HydrophobicContact CE2-CB 3.93Å; F103-L111 HydrophobicContact CE2-CD1 3.69Å; F103-L111 HydrophobicContact CE2-CG 3.91Å; F103-L111 HydrophobicContact CZ-CB 4.21Å; F103-L111 HydrophobicContact CZ-CD1 3.56Å; F103-L111 HydrophobicContact CZ-CG 3.7Å; T109-L111 PolarHBondContact O-N 3.41Å
112	A	29.2	Very low	32.6	Very low	71 Å²	71	100.5 Å²	100.5	59%	0.587	57%	0.568	S	S	*	*			trans	-67.8	142.5	162.6	0	0	0	0	0	109.8	N114	A112-N114 PolarHBondContact O-N 3.17Å; A112-N114 VanDerWaalsContact O-N 3.15Å
113	C	30.4	Very low	32.9	Very low	84 Å²	84	100.2 Å²	100.2	57%	0.568	57%	0.565	S	S	*	*			trans	-68.3	113.4	-177.9	-171.9	0	0	0	0	111.5
114	N	33.2	Very low	33.1	Very low	66 Å²	66	100.5 Å²	100.5	35%	0.353	57%	0.567	S	S	.	*			trans	-99.2	36.4	178.6	-80.3	-9.7	0	0	0	112.9	A112 H116 L117	A112-N114 PolarHBondContact O-N 3.17Å; A112-N114 VanDerWaalsContact O-N 3.15Å; N114-H116 PolarHBondContact O-N 3.41Å; N114-L117 HydrophobicContact CB-CB 4.5Å; N114-L117 HydrophobicContact CB-CD1 3.81Å; N114-L117 HydrophobicContact CB-CG 4.07Å; N114-L117 PolarHBondContact O-N 3.13Å
115	S	35.3	Very low	33.6	Very low	34 Å²	34	99.1 Å²	99.1	24%	0.238	57%	0.565	C	S	.	*	T	Hydrogen-bonded Turn	trans	-58.5	-10.9	177.4	55.5	0	0	0	0	115.3	H120 I126	S115-H120 PolarHBondContact O-CE1 2.98Å; S115-I126 WeakPolarHBondContact OG-CD1 3.45Å
116	H	39.3	Very low	33.8	Very low	87 Å²	87	98.3 Å²	98.3	40%	0.403	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.6	-10.6	175.7	63.2	-75.5	0	0	0	113.7	N114	N114-H116 PolarHBondContact O-N 3.41Å
117	L	40	Very low	33.9	Very low	55 Å²	55	95.6 Å²	95.6	29%	0.288	54%	0.539	S	S	.	.	S	Bend	trans	-84.7	-13.1	176.1	-63.9	-175.8	0	0	0	113	N114 M418	N114-L117 HydrophobicContact CB-CB 4.5Å; N114-L117 HydrophobicContact CB-CD1 3.81Å; N114-L117 HydrophobicContact CB-CG 4.07Å; N114-L117 PolarHBondContact O-N 3.13Å; L117-M418 HydrophobicContact CD1-CE 3.96Å; L117-M418 HydrophobicContact CD2-CG 4.41Å
118	T	34.2	Very low	34.4	Very low	88 Å²	88	95 Å²	95	54%	0.54	54%	0.543	S	S	.	.	S	Bend	trans	-92.9	129.9	172.5	3.7	0	0	0	0	110.1	H120	T118-H120 PolarHBondContact O-CE1 3.03Å; T118-H120 PolarHBondContact O-N 3.42Å; T118-H120 PolarHBondContact O-ND1 3.34Å; T118-H120 PolarHBondContact OG1-CE1 2.79Å
119	K	34	Very low	34.8	Very low	147 Å²	147	86.7 Å²	86.7	64%	0.639	51%	0.511	S	S	*	.			trans	-67.8	112.6	170.1	-81.2	-165.1	178.2	-167.8	0	109.5	S553	K119-S553 WeakPolarHBondContact CE-OG 3.25Å; K119-S553 PolarHBondContact NZ-OG 3.38Å
120	H	33.7	Very low	35.4	Very low	92 Å²	92	91.4 Å²	91.4	43%	0.426	53%	0.533	S	S	.	.			trans	-107.7	128.1	170.6	-58.1	79.4	0	0	0	108.7	S115 T118 V122	S115-H120 PolarHBondContact O-CE1 2.98Å; T118-H120 PolarHBondContact O-CE1 3.03Å; T118-H120 PolarHBondContact O-N 3.42Å; T118-H120 PolarHBondContact O-ND1 3.34Å; T118-H120 PolarHBondContact OG1-CE1 2.79Å; H120-V122 WeakPolarHBondContact CB-O 3.43Å; H120-V122 PolarHBondContact O-N 3.26Å
121	A	34.3	Very low	36.1	Very low	114 Å²	114	91 Å²	91	94%	0.942	54%	0.536	S	S	*	.	S	Bend	trans	-65.5	-20.3	175.9	0	0	0	0	0	113.1
122	V	33.2	Very low	36.9	Very low	81 Å²	81	88.4 Å²	88.4	49%	0.491	53%	0.527	S	S	.	.	S	Bend	trans	-140	128.5	169.9	-173.6	0	0	0	0	108	H120 Q124	H120-V122 WeakPolarHBondContact CB-O 3.43Å; H120-V122 PolarHBondContact O-N 3.26Å; V122-Q124 HydrophobicContact CB-CG 4.2Å; V122-Q124 HydrophobicContact CG1-CG 3.72Å; V122-Q124 PolarHBondContact O-N 3.21Å
123	P	35.1	Very low	37.6	Very low	125 Å²	125	93 Å²	93	81%	0.812	54%	0.542	S	S	*	.			trans	-72.5	108	177.2	28.9	-33.2	0	0	0	110.5
124	Q	33.9	Very low	38.2	Very low	102 Å²	102	95.1 Å²	95.1	48%	0.477	54%	0.544	S	S	.	.			trans	-135.7	13.4	-179.9	-54	-159.2	-69.3	0	0	114.1	V122 L139	V122-Q124 HydrophobicContact CB-CG 4.2Å; V122-Q124 HydrophobicContact CG1-CG 3.72Å; V122-Q124 PolarHBondContact O-N 3.21Å; Q124-L139 WeakPolarHBondContact O-CD1 3.48Å
125	A	40.5	Very low	38.6	Very low	36 Å²	36	96 Å²	96	30%	0.298	56%	0.555	S	S	.	*	S	Bend	trans	-90.4	-17.6	-162.8	0	0	0	0	0	116.8	N136	A125-N136 PolarHBondContact O-ND2 3.17Å
126	I	39	Very low	39	Very low	90 Å²	90	97.1 Å²	97.1	46%	0.462	56%	0.558	S	S	.	*			trans	-142.3	114.3	178.8	-56.4	-179.3	0	0	0	110.1	S115 N136	S115-I126 WeakPolarHBondContact OG-CD1 3.45Å; I126-N136 WeakPolarHBondContact CA-OD1 3.47Å
127	E	36.9	Very low	39.2	Very low	102 Å²	102	95.6 Å²	95.6	48%	0.477	56%	0.561	S	S	.	*			trans	-99	109.3	160.2	-169.9	173.2	-141.8	0	0	108.7	C129 N136 H138	E127-C129 PolarHBondContact O-N 3.25Å; E127-C129 VanDerWaalsContact O-N 3.14Å; E127-N136 PolarHBondContact N-OD1 2.95Å; E127-N136 VanDerWaalsContact N-OD1 3.12Å; E127-H138 IonicContact OE2-CD2 3.57Å
128	C	43.7	Very low	39.4	Very low	106 Å²	106	98.8 Å²	98.8	72%	0.716	57%	0.574	S	S	*	*			trans	-66.8	111.8	176.6	-74	0	0	0	0	109.7	N130	C128-N130 PolarHBondContact O-N 2.74Å
129	C	37.7	Very low	39.6	Very low	32 Å²	32	98.4 Å²	98.4	22%	0.216	57%	0.568	C	S	.	*			trans	-67.6	102.7	177.9	-74.8	0	0	0	0	111	E127 S131 S132 M134 C135	E127-C129 PolarHBondContact O-N 3.25Å; E127-C129 VanDerWaalsContact O-N 3.14Å; C129-S131 PolarHBondContact O-N 3.01Å; C129-S132 WeakPolarHBondContact CB-O 3.36Å; C129-S132 WeakPolarHBondContact CB-OG 3.3Å; C129-S132 PolarHBondContact SG-OG 3.48Å; C129-S132 VanDerWaalsContact SG-OG 3.4Å; C129-M134 PolarHBondContact SG-O 2.61Å; C129-C135 VanDerWaalsContact SG-CA 3.59Å
130	N	43	Very low	39.8	Very low	170 Å²	170	100 Å²	100	91%	0.909	58%	0.576	S	S	*	*	S	Bend	trans	-75.9	0.9	178.7	-151.4	17.3	0	0	0	112.9	C128	C128-N130 PolarHBondContact O-N 2.74Å
131	S	43.7	Very low	39.8	Very low	123 Å²	123	98.7 Å²	98.7	86%	0.86	58%	0.575	S	S	*	*	S	Bend	trans	-155.5	4.3	-171.5	55.6	0	0	0	0	115.2	C129	C129-S131 PolarHBondContact O-N 3.01Å
132	S	43.9	Very low	39.7	Very low	52 Å²	52	100 Å²	100	36%	0.364	56%	0.556	S	S	.	*			trans	-147.9	163.2	-177.5	93.8	0	0	0	0	112.5	C129 M134	C129-S132 WeakPolarHBondContact CB-O 3.36Å; C129-S132 WeakPolarHBondContact CB-OG 3.3Å; C129-S132 PolarHBondContact SG-OG 3.48Å; C129-S132 VanDerWaalsContact SG-OG 3.4Å; S132-M134 VanDerWaalsContact C-N 3.28Å; S132-M134 PolarHBondContact O-N 3.32Å; S132-M134 PolarHBondContact OG-N 3.04Å
133	N	44.4	Very low	39.8	Very low	168 Å²	168	101.5 Å²	101.5	90%	0.898	56%	0.556	S	S	*	*	S	Bend	trans	-84.4	2	178	-63.3	-16.5	0	0	0	113.4
134	M	42.8	Very low	40	Very low	127 Å²	127	99.3 Å²	99.3	63%	0.626	54%	0.536	S	S	*	.			trans	-119	72	-165.5	-61.1	-118	-65.4	0	0	111.8	C129 S132 N136 A137	C129-M134 PolarHBondContact SG-O 2.61Å; S132-M134 VanDerWaalsContact C-N 3.28Å; S132-M134 PolarHBondContact O-N 3.32Å; S132-M134 PolarHBondContact OG-N 3.04Å; M134-N136 PolarHBondContact O-N 3.49Å; M134-A137 HydrophobicContact CB-CB 3.84Å; M134-A137 HydrophobicContact CE-CB 4.25Å; M134-A137 VanDerWaalsContact O-CB 3.29Å; M134-A137 WeakPolarHBondContact O-CB 3.13Å; M134-A137 PolarHBondContact O-N 3.46Å; M134-A137 VanDerWaalsContact O-N 3.17Å
135	C	41.2	Very low	40.2	Very low	84 Å²	84	100.8 Å²	100.8	57%	0.568	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.7	136.9	168.8	-57.9	0	0	0	0	110.3	C129 A137	C129-C135 VanDerWaalsContact SG-CA 3.59Å; C135-A137 PolarHBondContact O-N 2.86Å
136	N	44.4	Very low	40.5	Very low	59 Å²	59	100.7 Å²	100.7	32%	0.316	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	8.4	178.6	-59.7	-7.5	0	0	0	116.9	A125 I126 E127 M134 H138 L139	A125-N136 PolarHBondContact O-ND2 3.17Å; I126-N136 WeakPolarHBondContact CA-OD1 3.47Å; E127-N136 PolarHBondContact N-OD1 2.95Å; E127-N136 VanDerWaalsContact N-OD1 3.12Å; M134-N136 PolarHBondContact O-N 3.49Å; N136-H138 PolarHBondContact O-N 2.88Å; N136-L139 HydrophobicContact CB-CB 4.39Å; N136-L139 HydrophobicContact CB-CD1 3.68Å; N136-L139 HydrophobicContact CB-CG 3.92Å; N136-L139 VanDerWaalsContact CG-CD1 3.42Å; N136-L139 WeakPolarHBondContact O-CB 3.5Å; N136-L139 PolarHBondContact O-N 2.86Å
137	A	43.5	Very low	40.8	Very low	55 Å²	55	105.1 Å²	105.1	46%	0.455	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.3	-14.7	175.1	0	0	0	0	0	114.9	M134 C135	M134-A137 HydrophobicContact CB-CB 3.84Å; M134-A137 HydrophobicContact CE-CB 4.25Å; M134-A137 VanDerWaalsContact O-CB 3.29Å; M134-A137 WeakPolarHBondContact O-CB 3.13Å; M134-A137 PolarHBondContact O-N 3.46Å; M134-A137 VanDerWaalsContact O-N 3.17Å; C135-A137 PolarHBondContact O-N 2.86Å
138	H	45.4	Very low	41.4	Very low	122 Å²	122	103.2 Å²	103.2	57%	0.565	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	0.7	177.3	-53.7	-49.9	0	0	0	113.4	E127 N136 F140	E127-H138 IonicContact OE2-CD2 3.57Å; N136-H138 PolarHBondContact O-N 2.88Å; H138-F140 VanDerWaalsContact O-CD2 3.31Å; H138-F140 WeakPolarHBondContact O-CD2 3.4Å; H138-F140 PolarHBondContact O-N 3.34Å
139	L	38.1	Very low	41.6	Very low	80 Å²	80	100.6 Å²	100.6	42%	0.419	53%	0.529	S	S	.	.			trans	-79.4	101.1	175	-66.4	-171.3	0	0	0	110.2	Q124 N136	Q124-L139 WeakPolarHBondContact O-CD1 3.48Å; N136-L139 HydrophobicContact CB-CB 4.39Å; N136-L139 HydrophobicContact CB-CD1 3.68Å; N136-L139 HydrophobicContact CB-CG 3.92Å; N136-L139 VanDerWaalsContact CG-CD1 3.42Å; N136-L139 WeakPolarHBondContact O-CB 3.5Å; N136-L139 PolarHBondContact O-N 2.86Å
140	F	36.9	Very low	42.3	Very low	181 Å²	181	104.5 Å²	104.5	79%	0.794	55%	0.548	S	S	*	.			trans	-74.8	138.1	170.9	-67.4	-86.1	0	0	0	110.9	H138 R142	H138-F140 VanDerWaalsContact O-CD2 3.31Å; H138-F140 WeakPolarHBondContact O-CD2 3.4Å; H138-F140 PolarHBondContact O-N 3.34Å; F140-R142 PolarHBondContact O-N 3.39Å
141	P	34.4	Very low	42.7	Very low	64 Å²	64	97.9 Å²	97.9	42%	0.416	51%	0.512	S	S	.	.			trans	-61.6	109	168.3	27	-33	0	0	0	108.3	F143	P141-F143 HydrophobicContact CB-CZ 4.28Å; P141-F143 HydrophobicContact CG-CE2 4.5Å; P141-F143 HydrophobicContact CG-CZ 4.28Å; P141-F143 VanDerWaalsContact O-CE2 3.3Å; P141-F143 WeakPolarHBondContact O-CE2 3.3Å
142	R	32.8	Very low	43	Very low	142 Å²	142	93 Å²	93	54%	0.536	48%	0.479	S	S	.	.			trans	-68.1	155	169.3	-151.5	168.1	-170.8	-171.8	-0.7	106.1	R97 F140	R97-R142 WeakPolarHBondContact CD-O 3.46Å; R97-R142 VanDerWaalsContact NH1-CB 3.35Å; R97-R142 PolarHBondContact NH1-O 3.03Å; F140-R142 PolarHBondContact O-N 3.39Å
143	F	35.3	Very low	43.2	Very low	112 Å²	112	93.9 Å²	93.9	49%	0.491	48%	0.482	S	S	.	.			trans	-119.1	139.7	174.7	-66.2	-78	0	0	0	110.9	F95 R97 P141	F95-F143 HydrophobicContact CB-CD1 4.37Å; F95-F143 HydrophobicContact CD1-CB 3.81Å; F95-F143 AromaticContact CD1-CD1 3.24Å; F95-F143 HydrophobicContact CD1-CD1 3.24Å; F95-F143 AromaticContact CD1-CE1 3.96Å; F95-F143 HydrophobicContact CD1-CE1 3.96Å; F95-F143 AromaticContact CD1-CG 3.64Å; F95-F143 HydrophobicContact CD1-CG 3.64Å; F95-F143 HydrophobicContact CE1-CB 3.83Å; F95-F143 AromaticContact CE1-CD1 3.66Å; F95-F143 HydrophobicContact CE1-CD1 3.66Å; F95-F143 HydrophobicContact CE1-CD2 4.27Å; F95-F143 HydrophobicContact CE1-CE1 4.29Å; F95-F143 AromaticContact CE1-CG 3.64Å; F95-F143 HydrophobicContact CE1-CG 3.64Å; F95-F143 AromaticContact CG-CD1 3.98Å; F95-F143 HydrophobicContact CG-CD1 3.98Å; F95-F143 HydrophobicContact CG-CE1 4.35Å; R97-F143 PolarHBondContact NH1-O 3.05Å; P141-F143 HydrophobicContact CB-CZ 4.28Å; P141-F143 HydrophobicContact CG-CE2 4.5Å; P141-F143 HydrophobicContact CG-CZ 4.28Å; P141-F143 VanDerWaalsContact O-CE2 3.3Å; P141-F143 WeakPolarHBondContact O-CE2 3.3Å
144	I	38.9	Very low	43.7	Very low	78 Å²	78	89.8 Å²	89.8	40%	0.4	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-96.6	116.1	173.6	-58.2	-178.4	0	0	0	106.3	R97	R97-I144 HydrophobicContact CG-CD1 4.27Å; R97-I144 HydrophobicContact CG-CG1 4.13Å; R97-I144 VanDerWaalsContact CZ-CG1 3.46Å
145	H	38	Very low	44.1	Very low	133 Å²	133	86.1 Å²	86.1	62%	0.616	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-82.6	126.9	168.4	-80	-64.6	0	0	0	108.9
146	H	46.5	Very low	44.4	Very low	35 Å²	35	84.3 Å²	84.3	16%	0.162	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-86.7	141.5	159.5	-64.3	-86.2	0	0	0	108.2	T148 D151 A152 T155	H146-T148 VanDerWaalsContact C-N 3.34Å; H146-D151 HydrophobicContact CB-CB 4.12Å; H146-A152 HydrophobicContact CB-CB 3.96Å; H146-T155 PolarHBondContact CE1-OG1 2.78Å
147	E	46.3	Very low	44.7	Very low	182 Å²	182	86.7 Å²	86.7	85%	0.85	44%	0.442	S	S	*	.	S	Bend	trans	-66.1	-38.9	-177.8	-64.2	-173.6	160.2	0	0	111.3
148	T	49	Very low	45.1	Very low	63 Å²	63	85.9 Å²	85.9	39%	0.387	43%	0.429	S	S	.	.	S	Bend	trans	-120.2	154.8	174.2	77.5	0	0	0	0	112.3	H146 L150 D151 A152	H146-T148 VanDerWaalsContact C-N 3.34Å; T148-L150 PolarHBondContact O-N 2.84Å; T148-L150 WeakPolarHBondContact OG1-CB 3.47Å; T148-L150 PolarHBondContact OG1-N 3.35Å; T148-D151 WeakPolarHBondContact CB-OD2 3.39Å; T148-D151 PolarHBondContact O-N 3.28Å; T148-D151 VanDerWaalsContact OG1-CG 3.26Å; T148-D151 PolarHBondContact OG1-N 2.89Å; T148-D151 PolarHBondContact OG1-OD2 3Å; T148-A152 PolarHBondContact O-N 3.35Å
149	D	48.4	Very low	45.2	Very low	50 Å²	50	84.5 Å²	84.5	27%	0.267	42%	0.423	S	S	.	.	H	α-helix	trans	-61.5	-25.9	170.7	-62.2	-16.9	0	0	0	111.1	A152 V153	D149-A152 PolarHBondContact O-N 3.13Å; D149-V153 WeakPolarHBondContact O-CG2 3.36Å; D149-V153 PolarHBondContact O-N 3.03Å
150	L	52.1	Low	45.7	Very low	115 Å²	115	85.7 Å²	85.7	60%	0.602	42%	0.424	S	S	*	.	H	α-helix	trans	-70.6	-37	178.5	-148.4	150.6	0	0	0	111.3	T148 V153 R154	T148-L150 PolarHBondContact O-N 2.84Å; T148-L150 WeakPolarHBondContact OG1-CB 3.47Å; T148-L150 PolarHBondContact OG1-N 3.35Å; L150-V153 PolarHBondContact O-N 3.2Å; L150-R154 VanDerWaalsContact O-CB 3.3Å; L150-R154 WeakPolarHBondContact O-CB 3.44Å; L150-R154 PolarHBondContact O-N 2.71Å
151	D	51.7	Low	46.1	Very low	31 Å²	31	79.5 Å²	79.5	17%	0.166	41%	0.412	C	S	.	.	H	α-helix	trans	-70.7	-37.9	173.1	-64.1	-54.6	0	0	0	112.3	H146 T148 V153 R154 T155	H146-D151 HydrophobicContact CB-CB 4.12Å; T148-D151 WeakPolarHBondContact CB-OD2 3.39Å; T148-D151 PolarHBondContact O-N 3.28Å; T148-D151 VanDerWaalsContact OG1-CG 3.26Å; T148-D151 PolarHBondContact OG1-N 2.89Å; T148-D151 PolarHBondContact OG1-OD2 3Å; D151-V153 VanDerWaalsContact C-N 3.35Å; D151-V153 PolarHBondContact O-N 2.83Å; D151-R154 PolarHBondContact O-N 2.98Å; D151-R154 IonicContact OD1-CZ 3.36Å; D151-R154 IonicContact OD1-NH1 2.85Å; D151-R154 PolarHBondContact OD1-NH1 2.97Å; D151-T155 WeakPolarHBondContact O-CB 3.41Å; D151-T155 PolarHBondContact O-N 3.34Å; D151-T155 PolarHBondContact O-OG1 2.86Å; D151-T155 VanDerWaalsContact O-OG1 3.04Å
152	A	48	Very low	46.4	Very low	21 Å²	21	79.3 Å²	79.3	17%	0.174	40%	0.404	C	S	.	.	H	α-helix	trans	-60.8	-45.1	172.6	0	0	0	0	0	111.2	I96 H146 T148 D149 A156	I96-A152 HydrophobicContact CD1-CB 4.24Å; I96-A152 WeakPolarHBondContact CD1-O 3.19Å; H146-A152 HydrophobicContact CB-CB 3.96Å; T148-A152 PolarHBondContact O-N 3.35Å; D149-A152 PolarHBondContact O-N 3.13Å; A152-A156 WeakPolarHBondContact O-CB 3.44Å; A152-A156 PolarHBondContact O-N 3.29Å
153	V	49.8	Very low	46.9	Very low	70 Å²	70	75.5 Å²	75.5	42%	0.424	40%	0.397	S	S	.	.	H	α-helix	trans	-64.6	-41.2	175.2	170.8	0	0	0	0	111.5	D149 L150 D151 A156 L157	D149-V153 WeakPolarHBondContact O-CG2 3.36Å; D149-V153 PolarHBondContact O-N 3.03Å; L150-V153 PolarHBondContact O-N 3.2Å; D151-V153 VanDerWaalsContact C-N 3.35Å; D151-V153 PolarHBondContact O-N 2.83Å; V153-A156 PolarHBondContact O-N 3.06Å; V153-L157 HydrophobicContact CG1-CD1 3.81Å; V153-L157 HydrophobicContact CG1-CG 4.35Å; V153-L157 WeakPolarHBondContact O-CB 3.3Å; V153-L157 VanDerWaalsContact O-CG 3.3Å; V153-L157 WeakPolarHBondContact O-CG 3.22Å; V153-L157 PolarHBondContact O-N 2.88Å
154	R	54.6	Low	47.1	Very low	82 Å²	82	73.3 Å²	73.3	31%	0.309	41%	0.406	S	S	.	.	H	α-helix	trans	-60.3	-50.5	176.4	-169.7	-175	-65.6	155.5	-13.2	111.2	L150 D151 A156 L157 E158	L150-R154 VanDerWaalsContact O-CB 3.3Å; L150-R154 WeakPolarHBondContact O-CB 3.44Å; L150-R154 PolarHBondContact O-N 2.71Å; D151-R154 PolarHBondContact O-N 2.98Å; D151-R154 IonicContact OD1-CZ 3.36Å; D151-R154 IonicContact OD1-NH1 2.85Å; D151-R154 PolarHBondContact OD1-NH1 2.97Å; R154-A156 VanDerWaalsContact C-N 3.33Å; R154-A156 PolarHBondContact O-N 3.19Å; R154-L157 PolarHBondContact O-N 3.26Å; R154-E158 WeakPolarHBondContact O-CG 3.34Å; R154-E158 PolarHBondContact O-N 3.4Å
155	T	51.1	Low	46.9	Very low	50 Å²	50	73.7 Å²	73.7	31%	0.307	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-39	177	-57.2	0	0	0	0	112.1	H146 D151 H159	H146-T155 PolarHBondContact CE1-OG1 2.78Å; D151-T155 WeakPolarHBondContact O-CB 3.41Å; D151-T155 PolarHBondContact O-N 3.34Å; D151-T155 PolarHBondContact O-OG1 2.86Å; D151-T155 VanDerWaalsContact O-OG1 3.04Å; T155-H159 PolarHBondContact O-N 3.04Å; T155-H159 VanDerWaalsContact O-N 3.09Å
156	A	48	Very low	46.8	Very low	45 Å²	45	72.2 Å²	72.2	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-62.7	-44.1	174.6	0	0	0	0	0	112.3	I96 A152 V153 R154 H159 F160	I96-A156 HydrophobicContact CD1-CB 3.91Å; A152-A156 WeakPolarHBondContact O-CB 3.44Å; A152-A156 PolarHBondContact O-N 3.29Å; V153-A156 PolarHBondContact O-N 3.06Å; R154-A156 VanDerWaalsContact C-N 3.33Å; R154-A156 PolarHBondContact O-N 3.19Å; A156-H159 PolarHBondContact O-N 2.94Å; A156-F160 WeakPolarHBondContact O-CB 3.31Å; A156-F160 PolarHBondContact O-N 3.32Å
157	L	50	Low	46	Very low	110 Å²	110	79.4 Å²	79.4	58%	0.576	42%	0.423	S	S	*	.	H	α-helix	trans	-69.6	-36.9	178.9	-71.3	171.3	0	0	0	112.6	V153 R154 H159 F160 G161	V153-L157 HydrophobicContact CG1-CD1 3.81Å; V153-L157 HydrophobicContact CG1-CG 4.35Å; V153-L157 WeakPolarHBondContact O-CB 3.3Å; V153-L157 VanDerWaalsContact O-CG 3.3Å; V153-L157 WeakPolarHBondContact O-CG 3.22Å; V153-L157 PolarHBondContact O-N 2.88Å; R154-L157 PolarHBondContact O-N 3.26Å; L157-H159 VanDerWaalsContact C-N 3.34Å; L157-F160 WeakPolarHBondContact O-CB 2.78Å; L157-F160 PolarHBondContact O-N 3.14Å; L157-G161 PolarHBondContact O-N 3.25Å
158	E	50.8	Low	45.4	Very low	38 Å²	38	80.1 Å²	80.1	18%	0.178	43%	0.427	C	S	.	.	H	α-helix	trans	-63.9	-38.9	173.4	-74.4	179.6	138.5	0	0	112	R154 G161 K162 T491	R154-E158 WeakPolarHBondContact O-CG 3.34Å; R154-E158 PolarHBondContact O-N 3.4Å; E158-G161 PolarHBondContact O-N 2.85Å; E158-K162 WeakPolarHBondContact O-CG 3.45Å; E158-K162 PolarHBondContact O-N 3.38Å; E158-K162 VanDerWaalsContact O-N 3.13Å; E158-T491 VanDerWaalsContact OE1-CB 3.22Å; E158-T491 WeakPolarHBondContact OE1-CB 3.49Å; E158-T491 PolarHBondContact OE1-OG1 2.97Å
159	H	48.7	Very low	44.7	Very low	93 Å²	93	84.1 Å²	84.1	43%	0.431	44%	0.441	S	S	.	.	H	α-helix	trans	-65.8	-40.5	171.6	-126.5	69.5	0	0	0	111.2	T155 A156 L157 G161 K162 T163	T155-H159 PolarHBondContact O-N 3.04Å; T155-H159 VanDerWaalsContact O-N 3.09Å; A156-H159 PolarHBondContact O-N 2.94Å; L157-H159 VanDerWaalsContact C-N 3.34Å; H159-G161 VanDerWaalsContact C-N 3.27Å; H159-G161 PolarHBondContact O-N 2.82Å; H159-K162 PolarHBondContact O-N 2.86Å; H159-T163 WeakPolarHBondContact O-CG2 3.38Å; H159-T163 PolarHBondContact O-N 3.17Å; H159-T163 PolarHBondContact O-OG1 3.38Å
160	F	47.5	Very low	44.1	Very low	104 Å²	104	87.4 Å²	87.4	46%	0.456	47%	0.468	S	S	.	.	H	α-helix	trans	-55.8	-39.8	175.7	-140.6	-83.3	0	0	0	112.5	A156 L157 W166	A156-F160 WeakPolarHBondContact O-CB 3.31Å; A156-F160 PolarHBondContact O-N 3.32Å; L157-F160 WeakPolarHBondContact O-CB 2.78Å; L157-F160 PolarHBondContact O-N 3.14Å; F160-W166 AromaticContact CE1-CD1 3.86Å; F160-W166 AromaticContact CE1-NE1 3.94Å; F160-W166 AromaticContact CZ-NE1 3.82Å
161	G	45.2	Very low	43	Very low	51 Å²	51	90.4 Å²	90.4	53%	0.526	48%	0.482	S	S	.	.	H	α-helix	trans	-74.8	-41.3	177.5	0	0	0	0	0	114.1	L157 E158 H159	L157-G161 PolarHBondContact O-N 3.25Å; E158-G161 PolarHBondContact O-N 2.85Å; H159-G161 VanDerWaalsContact C-N 3.27Å; H159-G161 PolarHBondContact O-N 2.82Å
162	K	42.8	Very low	42.2	Very low	60 Å²	60	93.7 Å²	93.7	26%	0.261	51%	0.514	S	S	.	.	H	α-helix	trans	-76.7	-25.7	-172.8	-71.1	-174.5	-175.9	101.2	0	114.9	E158 H159 D489	E158-K162 WeakPolarHBondContact O-CG 3.45Å; E158-K162 PolarHBondContact O-N 3.38Å; E158-K162 VanDerWaalsContact O-N 3.13Å; H159-K162 PolarHBondContact O-N 2.86Å; K162-D489 HydrophobicContact CD-CB 4.42Å; K162-D489 VanDerWaalsContact CD-OD2 3.22Å; K162-D489 WeakPolarHBondContact CD-OD2 3.1Å; K162-D489 VanDerWaalsContact CE-CA 3.48Å; K162-D489 WeakPolarHBondContact CE-OD1 3.25Å; K162-D489 WeakPolarHBondContact CE-OD2 3.36Å; K162-D489 VanDerWaalsContact NZ-CG 3.31Å; K162-D489 IonicContact NZ-OD1 2.7Å; K162-D489 PolarHBondContact NZ-OD1 3.11Å; K162-D489 IonicContact NZ-OD2 3.54Å
163	T	42.1	Very low	41.5	Very low	62 Å²	62	97.1 Å²	97.1	38%	0.38	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-5.9	-172	55.5	0	0	0	0	114.8	H159 L165	H159-T163 WeakPolarHBondContact O-CG2 3.38Å; H159-T163 PolarHBondContact O-N 3.17Å; H159-T163 PolarHBondContact O-OG1 3.38Å; T163-L165 PolarHBondContact O-N 3.17Å; T163-L165 VanDerWaalsContact OG1-CD1 3.31Å; T163-L165 WeakPolarHBondContact OG1-CD1 3.2Å
164	G	39.2	Very low	40.6	Very low	66 Å²	66	96.9 Å²	96.9	68%	0.68	55%	0.549	S	S	*	.			trans	55.6	27.8	178	0	0	0	0	0	114.5	W166	G164-W166 PolarHBondContact O-N 3.38Å
165	L	36	Very low	39.4	Very low	86 Å²	86	99.4 Å²	99.4	45%	0.45	57%	0.568	S	S	.	*			trans	-72.6	-1.8	-161.5	-94.9	170.9	0	0	0	115.2	T163	T163-L165 PolarHBondContact O-N 3.17Å; T163-L165 VanDerWaalsContact OG1-CD1 3.31Å; T163-L165 WeakPolarHBondContact OG1-CD1 3.2Å
166	W	34.8	Very low	38.4	Very low	102 Å²	102	102.3 Å²	102.3	39%	0.386	58%	0.581	S	S	.	*			trans	-136	138.7	-173.6	-61.5	100.8	0	0	0	111.5	F160 G164 I176 R177 L178	F160-W166 AromaticContact CE1-CD1 3.86Å; F160-W166 AromaticContact CE1-NE1 3.94Å; F160-W166 AromaticContact CZ-NE1 3.82Å; G164-W166 PolarHBondContact O-N 3.38Å; W166-I176 HydrophobicContact CD2-CG2 4.1Å; W166-I176 HydrophobicContact CE3-CG2 3.76Å; W166-I176 HydrophobicContact CH2-CG2 3.28Å; W166-I176 HydrophobicContact CZ2-CG2 3.66Å; W166-I176 HydrophobicContact CZ3-CG2 3.33Å; W166-R177 WeakPolarHBondContact CZ3-O 3.47Å; W166-L178 HydrophobicContact CH2-CB 4.47Å; W166-L178 HydrophobicContact CH2-CD2 4.03Å; W166-L178 HydrophobicContact CH2-CG 4.12Å; W166-L178 HydrophobicContact CZ2-CD2 3.85Å; W166-L178 HydrophobicContact CZ2-CG 4.33Å
167	R	30.6	Very low	37.6	Very low	186 Å²	186	110.6 Å²	110.6	70%	0.702	60%	0.603	S	S	*	*			trans	-95	133.3	163.2	-178.7	-166	-78.7	-178.3	-7.3	107	E169	R167-E169 WeakPolarHBondContact CD-OE1 3.19Å; R167-E169 HydrophobicContact CG-CG 4.34Å; R167-E169 IonicContact CZ-OE1 2.67Å; R167-E169 IonicContact NE-OE1 2.74Å; R167-E169 IonicContact NH1-OE1 3.46Å; R167-E169 PolarHBondContact NH1-OE1 3.18Å; R167-E169 PolarHBondContact O-N 3.46Å; R167-E169 VanDerWaalsContact O-N 3.13Å
168	E	34.1	Very low	36.6	Very low	198 Å²	198	111 Å²	111	93%	0.925	61%	0.605	S	S	*	*			trans	-67.2	106.1	164	-70.4	-176.5	139.7	0	0	108.8
169	E	33.1	Very low	35.7	Very low	146 Å²	146	116.8 Å²	116.8	68%	0.682	63%	0.625	S	S	*	*			trans	-108.6	147.4	161.1	-82.5	175.9	-170.2	0	0	108.9	R167	R167-E169 WeakPolarHBondContact CD-OE1 3.19Å; R167-E169 HydrophobicContact CG-CG 4.34Å; R167-E169 IonicContact CZ-OE1 2.67Å; R167-E169 IonicContact NE-OE1 2.74Å; R167-E169 IonicContact NH1-OE1 3.46Å; R167-E169 PolarHBondContact NH1-OE1 3.18Å; R167-E169 PolarHBondContact O-N 3.46Å; R167-E169 VanDerWaalsContact O-N 3.13Å
170	S	35.6	Very low	34.9	Very low	120 Å²	120	117.8 Å²	117.8	84%	0.839	64%	0.64	S	S	*	*			trans	-65.9	147.9	-152	43.5	0	0	0	0	115.9	A172	S170-A172 PolarHBondContact O-N 3.17Å
171	I	29.3	Very low	34.2	Very low	177 Å²	177	120.1 Å²	120.1	91%	0.908	65%	0.647	S	S	*	*	S	Bend	trans	-44.7	115.4	175.1	-58.3	160.5	0	0	0	111.9
172	A	35.8	Very low	33.5	Very low	100 Å²	100	122.7 Å²	122.7	83%	0.826	65%	0.646	S	S	*	*	S	Bend	trans	-162.9	-32	160.6	0	0	0	0	0	113.7	S170	S170-A172 PolarHBondContact O-N 3.17Å
173	S	32.3	Very low	32.8	Very low	93 Å²	93	123.5 Å²	123.5	65%	0.65	65%	0.653	S	S	*	*			trans	-145.6	132.9	175.4	68.8	0	0	0	0	111.7	N175	S173-N175 PolarHBondContact O-N 3.42Å
174	G	31.5	Very low	32.3	Very low	66 Å²	66	126.1 Å²	126.1	68%	0.68	67%	0.669	S	S	*	*			trans	-72.9	26.1	-170.1	0	0	0	0	0	116.6
175	N	28.8	Very low	31.7	Very low	134 Å²	134	124.7 Å²	124.7	72%	0.717	65%	0.654	S	S	*	*			trans	-99.7	88.4	-174.3	-79.1	-40.5	0	0	0	112.3	S173 R177	S173-N175 PolarHBondContact O-N 3.42Å; N175-R177 PolarHBondContact O-N 3.37Å
176	I	31.3	Very low	31.3	Very low	112 Å²	112	125.4 Å²	125.4	57%	0.574	66%	0.664	S	S	*	*			trans	-70.6	110.1	172.2	-62.1	175.4	0	0	0	109.3	L60 W166	L60-I176 HydrophobicContact CD1-CD1 4.42Å; W166-I176 HydrophobicContact CD2-CG2 4.1Å; W166-I176 HydrophobicContact CE3-CG2 3.76Å; W166-I176 HydrophobicContact CH2-CG2 3.28Å; W166-I176 HydrophobicContact CZ2-CG2 3.66Å; W166-I176 HydrophobicContact CZ3-CG2 3.33Å
177	R	29.7	Very low	31.2	Very low	219 Å²	219	126.8 Å²	126.8	83%	0.826	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-103.3	118.1	-178.5	-85.1	-175.1	167.9	177.4	-2.4	112.6	W166 N175	W166-R177 WeakPolarHBondContact CZ3-O 3.47Å; N175-R177 PolarHBondContact O-N 3.37Å
178	L	29.5	Very low	31.2	Very low	118 Å²	118	125.1 Å²	125.1	62%	0.618	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-54.1	143.1	173.2	-78.6	160.6	0	0	0	111.6	W166 M182	W166-L178 HydrophobicContact CH2-CB 4.47Å; W166-L178 HydrophobicContact CH2-CD2 4.03Å; W166-L178 HydrophobicContact CH2-CG 4.12Å; W166-L178 HydrophobicContact CZ2-CD2 3.85Å; W166-L178 HydrophobicContact CZ2-CG 4.33Å; L178-M182 HydrophobicContact CD2-SD 3.85Å
179	R	31.2	Very low	30.8	Very low	159 Å²	159	122.3 Å²	122.3	60%	0.6	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.3	131.6	171.6	-78.3	-174.3	177.4	-159.9	4.1	109.4	Y181	R179-Y181 HydrophobicContact CB-CD2 3.82Å; R179-Y181 HydrophobicContact CB-CE2 3.83Å; R179-Y181 HydrophobicContact CG-CD2 4.47Å; R179-Y181 HydrophobicContact CG-CE2 4.1Å; R179-Y181 PolarHBondContact O-N 2.95Å
180	P	32	Very low	30.6	Very low	115 Å²	115	122.9 Å²	122.9	75%	0.747	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-4.7	-174.6	-26.6	35.1	0	0	0	117.2
181	Y	32.8	Very low	30.2	Very low	153 Å²	153	121 Å²	121	60%	0.6	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	15.1	-168.1	-16.8	-68.4	0	0	0	113.3	R179	R179-Y181 HydrophobicContact CB-CD2 3.82Å; R179-Y181 HydrophobicContact CB-CE2 3.83Å; R179-Y181 HydrophobicContact CG-CD2 4.47Å; R179-Y181 HydrophobicContact CG-CE2 4.1Å; R179-Y181 PolarHBondContact O-N 2.95Å
182	M	30.5	Very low	30	Very low	104 Å²	104	116 Å²	116	51%	0.512	67%	0.67	S	S	.	*			trans	-95.2	107.5	-178.1	-74.8	-176.3	66.3	0	0	112.3	L178	L178-M182 HydrophobicContact CD2-SD 3.85Å
183	N	28.2	Very low	29.5	Very low	78 Å²	78	117.1 Å²	117.1	42%	0.417	67%	0.671	S	S	.	*			trans	-79.9	131.7	169.2	-69.8	-34.6	0	0	0	111.7	C102 F103 D104	C102-N183 PolarHBondContact O-ND2 2.73Å; F103-N183 PolarHBondContact O-ND2 3.07Å; D104-N183 PolarHBondContact N-ND2 2.93Å
184	V	31.2	Very low	29.3	Very low	116 Å²	116	117.4 Å²	117.4	70%	0.703	68%	0.679	S	S	*	*			trans	-120.4	131.5	168.5	-177.4	0	0	0	0	107.7
185	G	27.6	Very low	29	Very low	36 Å²	36	122.9 Å²	122.9	37%	0.371	69%	0.692	S	S	.	*			trans	-71.3	158.1	-175.3	0	0	0	0	0	114.2	D187	G185-D187 PolarHBondContact O-N 3.35Å
186	P	28.4	Very low	28.9	Very low	102 Å²	102	120 Å²	120	66%	0.662	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-75.6	-16.8	-162.8	-18.9	34.3	0	0	0	116.7	M188 L189	P186-M188 PolarHBondContact O-N 3.34Å; P186-L189 PolarHBondContact O-N 3.09Å; P186-L189 VanDerWaalsContact O-N 3.13Å
187	D	32	Very low	28.7	Very low	131 Å²	131	122.4 Å²	122.4	70%	0.701	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-71.6	-1.6	-169.8	-60.7	-56.4	0	0	0	115	G185	G185-D187 PolarHBondContact O-N 3.35Å
188	M	30.2	Very low	28.5	Very low	151 Å²	151	117.5 Å²	117.5	74%	0.744	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-90.6	7.5	170.2	-78.5	-168.4	67.2	0	0	114.4	P186	P186-M188 PolarHBondContact O-N 3.34Å
189	L	26.7	Very low	28.4	Very low	139 Å²	139	117.1 Å²	117.1	73%	0.728	71%	0.709	S	S	*	*			trans	-116.2	17.8	-173.8	-68.9	173.7	0	0	0	115.7	P186	P186-L189 PolarHBondContact O-N 3.09Å; P186-L189 VanDerWaalsContact O-N 3.13Å
190	I	28.1	Very low	28.3	Very low	157 Å²	157	117.2 Å²	117.2	81%	0.805	72%	0.716	S	S	*	*			trans	-97.2	100.5	174.3	-54.7	177.8	0	0	0	110.4
191	G	27	Very low	28.3	Very low	80 Å²	80	117.8 Å²	117.8	83%	0.825	71%	0.713	S	S	*	*			trans	149	74	169.5	0	0	0	0	0	115.1
192	G	25	Very low	28.2	Very low	73 Å²	73	120.5 Å²	120.5	75%	0.753	73%	0.728	S	S	*	*			trans	-174.2	74.8	178.5	0	0	0	0	0	116.1
193	S	26.4	Very low	28.5	Very low	123 Å²	123	121.4 Å²	121.4	86%	0.86	74%	0.739	S	S	*	*			trans	-159.8	153.6	156.5	-60	0	0	0	0	110.5
194	A	28	Very low	28.8	Very low	100 Å²	100	127.1 Å²	127.1	83%	0.826	76%	0.755	S	S	*	*			trans	71.1	104.5	173.6	0	0	0	0	0	117.5
195	L	24.9	Very low	28.8	Very low	181 Å²	181	128.2 Å²	128.2	95%	0.948	75%	0.754	S	S	*	*			trans	-50.9	149.9	164.9	-64.5	68.2	0	0	0	112.7
196	G	26.2	Very low	29.1	Very low	74 Å²	74	133.6 Å²	133.6	76%	0.763	77%	0.769	S	S	*	*			trans	166.4	110.3	166.5	0	0	0	0	0	113.2
197	N	27.4	Very low	29.6	Very low	161 Å²	161	136.2 Å²	136.2	86%	0.861	77%	0.77	S	S	*	*			trans	-49	140.4	-173.5	-62.3	-35.3	0	0	0	115.5
198	P	24.8	Very low	29.8	Very low	117 Å²	117	134 Å²	134	76%	0.76	76%	0.758	S	S	*	*			trans	-76.3	162.7	167.2	37.2	-36.7	0	0	0	110.3
199	P	28.4	Very low	29.9	Very low	110 Å²	110	135.8 Å²	135.8	71%	0.714	76%	0.756	S	S	*	*				-157.3	-175.8	96.3	42.3	-23.3	0	0	0	116.8
200	H	28.8	Very low	30.4	Very low	160 Å²	160	136.6 Å²	136.6	74%	0.741	75%	0.754	S	S	*	*			trans	55.6	97	158.4	-72.1	-75	0	0	0	120.2
201	N	32.7	Very low	31.1	Very low	127 Å²	127	134 Å²	134	68%	0.679	74%	0.742	S	S	*	*				175.6	91.3	107.1	-91.9	-44.3	0	0	0	113.2	V203	N201-V203 PolarHBondContact O-N 2.54Å; N201-V203 VanDerWaalsContact O-N 3.14Å
202	K	30.2	Very low	31.7	Very low	210 Å²	210	138 Å²	138	91%	0.913	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-14.9	176.3	-83.7	-174.7	173.4	180	0	114.7
203	V	37.7	Very low	32.4	Very low	124 Å²	124	138 Å²	138	75%	0.752	72%	0.717	S	S	*	*	H	α-helix	trans	-80.8	-24.7	-174.6	-176.3	0	0	0	0	113.3	N201	N201-V203 PolarHBondContact O-N 2.54Å; N201-V203 VanDerWaalsContact O-N 3.14Å
204	R	33	Very low	33.1	Very low	198 Å²	198	135.7 Å²	135.7	75%	0.747	70%	0.701	S	S	*	*	H	α-helix	trans	-80.9	-27.8	-171.5	-156.2	171	-173.6	170.5	1.8	114.3	K207 L208	R204-K207 PolarHBondContact O-N 3.18Å; R204-L208 PolarHBondContact O-N 3.3Å
205	M	30.7	Very low	34	Very low	138 Å²	138	133.5 Å²	133.5	68%	0.68	68%	0.68	S	S	*	*	H	α-helix	trans	-69.5	-33.8	179.9	-80.3	-64.4	179.8	0	0	113.2	K207 L208 W209	M205-K207 PolarHBondContact O-N 2.99Å; M205-L208 PolarHBondContact O-N 3.32Å; M205-L208 HydrophobicContact SD-CD1 4.28Å; M205-W209 PolarHBondContact O-N 2.97Å
206	H	34.7	Very low	35	Very low	150 Å²	150	131 Å²	131	69%	0.694	66%	0.663	S	S	*	*	H	α-helix	trans	-66	-25.4	178.6	-161	-69.5	0	0	0	112.8	K210	H206-K210 PolarHBondContact O-N 3.44Å
207	K	38.3	Very low	36.2	Very low	156 Å²	156	132.2 Å²	132.2	68%	0.678	65%	0.652	S	S	*	*	H	α-helix	trans	-77.2	-45.9	173.5	-154.1	170.9	-174.2	178.4	0	111.2	R204 M205 W209 K210 D211	R204-K207 PolarHBondContact O-N 3.18Å; M205-K207 PolarHBondContact O-N 2.99Å; K207-W209 VanDerWaalsContact C-N 3.29Å; K207-W209 PolarHBondContact O-N 3.24Å; K207-K210 PolarHBondContact O-N 3Å; K207-D211 PolarHBondContact O-N 3.13Å
208	L	37.5	Very low	37.5	Very low	84 Å²	84	133.8 Å²	133.8	44%	0.44	65%	0.646	S	S	.	*	H	α-helix	trans	-63.7	-28.7	176.1	-73.8	170.1	0	0	0	114	R204 M205 R212	R204-L208 PolarHBondContact O-N 3.3Å; M205-L208 PolarHBondContact O-N 3.32Å; M205-L208 HydrophobicContact SD-CD1 4.28Å; L208-R212 WeakPolarHBondContact O-CB 3.36Å; L208-R212 PolarHBondContact O-N 3.38Å; L208-R212 VanDerWaalsContact O-N 3.13Å
209	W	31.8	Very low	38.9	Very low	190 Å²	190	134.6 Å²	134.6	72%	0.72	64%	0.641	S	S	*	*	H	α-helix	trans	-72.8	-40.8	175.1	-148.2	62.3	0	0	0	111.3	M205 K207 D211 R212 V213	M205-W209 PolarHBondContact O-N 2.97Å; K207-W209 VanDerWaalsContact C-N 3.29Å; K207-W209 PolarHBondContact O-N 3.24Å; W209-D211 PolarHBondContact O-N 3.46Å; W209-R212 PolarHBondContact O-N 3.42Å; W209-R212 VanDerWaalsContact O-N 3.14Å; W209-V213 WeakPolarHBondContact O-CG2 3.26Å; W209-V213 PolarHBondContact O-N 3.13Å
210	K	37.6	Very low	40.4	Very low	155 Å²	155	135.7 Å²	135.7	67%	0.674	64%	0.637	S	S	*	*	H	α-helix	trans	-64.3	-39.6	176.2	-144	174.6	-172.6	-179	0	112.3	H206 K207 R212 S214	H206-K210 PolarHBondContact O-N 3.44Å; K207-K210 PolarHBondContact O-N 3Å; K210-R212 VanDerWaalsContact C-N 3.31Å; K210-R212 PolarHBondContact O-N 2.85Å; K210-S214 PolarHBondContact O-N 3.04Å
211	D	41.9	Very low	42.4	Very low	103 Å²	103	133 Å²	133	55%	0.551	63%	0.628	S	S	*	*	H	α-helix	trans	-69.1	-28.6	174.2	-63.8	-24	0	0	0	112.4	K207 W209	K207-D211 PolarHBondContact O-N 3.13Å; W209-D211 PolarHBondContact O-N 3.46Å
212	R	39.2	Very low	44.3	Very low	165 Å²	165	132 Å²	132	62%	0.623	62%	0.622	S	S	*	*	H	α-helix	trans	-76.6	-39.1	177.3	-152.3	177.3	-64.4	-152.3	0.5	112.3	L208 W209 K210 S214 S215 E216	L208-R212 WeakPolarHBondContact O-CB 3.36Å; L208-R212 PolarHBondContact O-N 3.38Å; L208-R212 VanDerWaalsContact O-N 3.13Å; W209-R212 PolarHBondContact O-N 3.42Å; W209-R212 VanDerWaalsContact O-N 3.14Å; K210-R212 VanDerWaalsContact C-N 3.31Å; K210-R212 PolarHBondContact O-N 2.85Å; R212-S214 VanDerWaalsContact C-N 3.28Å; R212-S214 PolarHBondContact O-N 3.31Å; R212-S215 WeakPolarHBondContact O-CB 3.36Å; R212-S215 PolarHBondContact O-N 3.43Å; R212-S215 PolarHBondContact O-OG 3.26Å; R212-E216 PolarHBondContact O-N 2.94Å
213	V	39.6	Very low	46.2	Very low	71 Å²	71	129.3 Å²	129.3	43%	0.43	61%	0.611	S	S	.	*	H	α-helix	trans	-60.2	-38.7	171.4	173	0	0	0	0	111	W209 S215 E216	W209-V213 WeakPolarHBondContact O-CG2 3.26Å; W209-V213 PolarHBondContact O-N 3.13Å; V213-S215 PolarHBondContact O-N 2.86Å; V213-S215 VanDerWaalsContact O-N 3.11Å; V213-E216 PolarHBondContact O-N 2.97Å; V213-E216 VanDerWaalsContact O-N 3.17Å
214	S	43	Very low	47.9	Very low	76 Å²	76	128.6 Å²	128.6	53%	0.531	60%	0.599	S	S	.	*	H	α-helix	trans	-62	-17	172.4	-179.4	0	0	0	0	114.5	K210 R212	K210-S214 PolarHBondContact O-N 3.04Å; R212-S214 VanDerWaalsContact C-N 3.28Å; R212-S214 PolarHBondContact O-N 3.31Å
215	S	46.7	Very low	50.3	Low	54 Å²	54	124.3 Å²	124.3	38%	0.378	59%	0.59	S	S	.	*	H	α-helix	trans	-89.8	-25.2	177.1	77.2	0	0	0	0	113.2	R212 V213 R218 M219	R212-S215 WeakPolarHBondContact O-CB 3.36Å; R212-S215 PolarHBondContact O-N 3.43Å; R212-S215 PolarHBondContact O-OG 3.26Å; V213-S215 PolarHBondContact O-N 2.86Å; V213-S215 VanDerWaalsContact O-N 3.11Å; S215-R218 PolarHBondContact O-N 3.43Å; S215-M219 PolarHBondContact O-N 2.87Å
216	E	45.2	Very low	52.8	Low	127 Å²	127	121.9 Å²	121.9	59%	0.593	58%	0.583	S	S	*	*	H	α-helix	trans	-69.1	-38.8	179	-70.3	-175.7	135.5	0	0	111.7	R212 V213 R218 M219 Q220	R212-E216 PolarHBondContact O-N 2.94Å; V213-E216 PolarHBondContact O-N 2.97Å; V213-E216 VanDerWaalsContact O-N 3.17Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 2.93Å; E216-M219 PolarHBondContact O-N 3.24Å; E216-M219 VanDerWaalsContact O-N 3.17Å; E216-Q220 PolarHBondContact O-N 3.24Å
217	D	50.5	Low	55.1	Low	101 Å²	101	118.3 Å²	118.3	54%	0.54	57%	0.568	S	S	.	*	H	α-helix	trans	-60.8	-38.1	173.1	-84.9	-19.3	0	0	0	112.8	N221	D217-N221 WeakPolarHBondContact O-CB 3.35Å; D217-N221 PolarHBondContact O-N 3.35Å; D217-N221 PolarHBondContact O-ND2 3.38Å
218	R	54.8	Low	57.4	Low	194 Å²	194	115.7 Å²	115.7	73%	0.732	56%	0.561	S	S	*	*	H	α-helix	trans	-70.1	-37.8	175.4	-76.9	-170.3	177.2	-169.4	0.5	111.7	S215 E216 L222	S215-R218 PolarHBondContact O-N 3.43Å; E216-R218 VanDerWaalsContact C-N 3.33Å; E216-R218 PolarHBondContact O-N 2.93Å; R218-L222 WeakPolarHBondContact O-CB 3.39Å; R218-L222 WeakPolarHBondContact O-CG 3.43Å; R218-L222 PolarHBondContact O-N 2.84Å
219	M	54.7	Low	59.7	Low	133 Å²	133	114.4 Å²	114.4	66%	0.655	56%	0.562	S	S	*	*	H	α-helix	trans	-65.7	-42.9	174.1	-80.5	-79.7	-77.8	0	0	111.8	S215 E216 L222 F223	S215-M219 PolarHBondContact O-N 2.87Å; E216-M219 PolarHBondContact O-N 3.24Å; E216-M219 VanDerWaalsContact O-N 3.17Å; M219-L222 PolarHBondContact O-N 3.19Å; M219-F223 WeakPolarHBondContact O-CB 3.4Å; M219-F223 PolarHBondContact O-N 3.47Å
220	Q	59.9	Low	62.2	Low	134 Å²	134	109 Å²	109	63%	0.626	55%	0.55	S	S	*	.	H	α-helix	trans	-63	-43.3	175.1	-83.2	-171.3	-18.3	0	0	112.3	E216 F223 Q224	E216-Q220 PolarHBondContact O-N 3.24Å; Q220-F223 PolarHBondContact O-N 3.23Å; Q220-Q224 WeakPolarHBondContact O-CB 3.46Å; Q220-Q224 WeakPolarHBondContact O-CG 3.41Å; Q220-Q224 PolarHBondContact O-N 3.28Å
221	N	70	Confident	64.7	Low	104 Å²	104	108.2 Å²	108.2	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-64.3	-41.7	175.9	-79.1	-57.4	0	0	0	112.4	D217 F223 Q224 I225	D217-N221 WeakPolarHBondContact O-CB 3.35Å; D217-N221 PolarHBondContact O-N 3.35Å; D217-N221 PolarHBondContact O-ND2 3.38Å; N221-F223 VanDerWaalsContact C-N 3.35Å; N221-Q224 PolarHBondContact O-N 2.85Å; N221-I225 WeakPolarHBondContact O-CD1 3.29Å; N221-I225 VanDerWaalsContact O-CG1 3.26Å; N221-I225 WeakPolarHBondContact O-CG1 3.31Å; N221-I225 PolarHBondContact O-N 3.31Å
222	L	73.4	Confident	67	Low	106 Å²	106	106.3 Å²	106.3	56%	0.555	54%	0.542	S	S	*	.	H	α-helix	trans	-62.6	-40.9	172.6	-81.6	165.1	0	0	0	112	R218 M219 I225 V226	R218-L222 WeakPolarHBondContact O-CB 3.39Å; R218-L222 WeakPolarHBondContact O-CG 3.43Å; R218-L222 PolarHBondContact O-N 2.84Å; M219-L222 PolarHBondContact O-N 3.19Å; L222-I225 PolarHBondContact O-N 2.92Å; L222-V226 WeakPolarHBondContact O-CG2 3.45Å; L222-V226 PolarHBondContact O-N 2.9Å
223	F	70.8	Confident	69.4	Low	152 Å²	152	104 Å²	104	67%	0.667	54%	0.541	S	S	*	.	H	α-helix	trans	-66.1	-41.5	178.2	-151	-85.7	0	0	0	111.7	M219 Q220 N221 V226 L227	M219-F223 WeakPolarHBondContact O-CB 3.4Å; M219-F223 PolarHBondContact O-N 3.47Å; Q220-F223 PolarHBondContact O-N 3.23Å; N221-F223 VanDerWaalsContact C-N 3.35Å; F223-V226 PolarHBondContact O-N 3.06Å; F223-L227 HydrophobicContact CE1-CD1 4.43Å; F223-L227 WeakPolarHBondContact O-CB 3.38Å; F223-L227 PolarHBondContact O-N 3.2Å
224	Q	73.4	Confident	71.8	Confident	110 Å²	110	104.4 Å²	104.4	51%	0.514	54%	0.543	S	S	.	.	H	α-helix	trans	-57.8	-47.6	170.9	-79.5	-78.9	-4.2	0	0	111.6	Q220 N221 V226 L227 I228	Q220-Q224 WeakPolarHBondContact O-CB 3.46Å; Q220-Q224 WeakPolarHBondContact O-CG 3.41Å; Q220-Q224 PolarHBondContact O-N 3.28Å; N221-Q224 PolarHBondContact O-N 2.85Å; Q224-V226 PolarHBondContact O-N 3.02Å; Q224-L227 WeakPolarHBondContact O-CB 3.32Å; Q224-L227 PolarHBondContact O-N 3.06Å; Q224-I228 WeakPolarHBondContact O-CB 3.2Å; Q224-I228 VanDerWaalsContact O-CG1 3.27Å; Q224-I228 WeakPolarHBondContact O-CG1 3.28Å; Q224-I228 PolarHBondContact O-N 3.02Å
225	I	81.9	Confident	74.1	Confident	107 Å²	107	107.7 Å²	107.7	55%	0.549	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-44.1	178.1	-69	163.4	0	0	0	111.3	N221 L222 L227 I228 A229	N221-I225 WeakPolarHBondContact O-CD1 3.29Å; N221-I225 VanDerWaalsContact O-CG1 3.26Å; N221-I225 WeakPolarHBondContact O-CG1 3.31Å; N221-I225 PolarHBondContact O-N 3.31Å; L222-I225 PolarHBondContact O-N 2.92Å; I225-L227 VanDerWaalsContact C-N 3.34Å; I225-I228 PolarHBondContact O-N 3.03Å; I225-A229 VanDerWaalsContact O-CB 3.31Å; I225-A229 WeakPolarHBondContact O-CB 3.11Å; I225-A229 PolarHBondContact O-N 3.17Å
226	V	84.8	Confident	76.3	Confident	87 Å²	87	109 Å²	109	53%	0.527	55%	0.554	S	S	.	*	H	α-helix	trans	-65.1	-38.2	176.2	172.4	0	0	0	0	111.4	L222 F223 Q224 A229 T230	L222-V226 WeakPolarHBondContact O-CG2 3.45Å; L222-V226 PolarHBondContact O-N 2.9Å; F223-V226 PolarHBondContact O-N 3.06Å; Q224-V226 PolarHBondContact O-N 3.02Å; V226-A229 PolarHBondContact O-N 2.98Å; V226-T230 HydrophobicContact CG1-CG2 4.45Å; V226-T230 WeakPolarHBondContact O-CB 3.5Å; V226-T230 WeakPolarHBondContact O-CG2 3.21Å; V226-T230 PolarHBondContact O-N 2.74Å; V226-T230 PolarHBondContact O-OG1 3.37Å
227	L	81.9	Confident	78.5	Confident	76 Å²	76	106.5 Å²	106.5	40%	0.398	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-47.8	175.7	-153	88.9	0	0	0	110.8	F223 Q224 I225 A229 T230 F231	F223-L227 HydrophobicContact CE1-CD1 4.43Å; F223-L227 WeakPolarHBondContact O-CB 3.38Å; F223-L227 PolarHBondContact O-N 3.2Å; Q224-L227 WeakPolarHBondContact O-CB 3.32Å; Q224-L227 PolarHBondContact O-N 3.06Å; I225-L227 VanDerWaalsContact C-N 3.34Å; L227-A229 VanDerWaalsContact C-N 3.35Å; L227-A229 PolarHBondContact O-N 3.25Å; L227-T230 WeakPolarHBondContact CA-OG1 3.44Å; L227-T230 PolarHBondContact O-N 2.88Å; L227-T230 PolarHBondContact O-OG1 3.08Å; L227-F231 HydrophobicContact CD2-CD2 4.35Å; L227-F231 HydrophobicContact CD2-CE2 4.12Å; L227-F231 HydrophobicContact CG-CD2 3.99Å; L227-F231 HydrophobicContact CG-CE2 4Å; L227-F231 WeakPolarHBondContact O-CB 3.22Å; L227-F231 WeakPolarHBondContact O-CD2 3.48Å; L227-F231 PolarHBondContact O-N 3.43Å
228	I	87.1	Confident	80.5	Confident	101 Å²	101	106.9 Å²	106.9	52%	0.518	55%	0.549	S	S	.	.	H	α-helix	trans	-61.5	-43.5	177.6	-68.2	163.7	0	0	0	110.6	Q224 I225 S232	Q224-I228 WeakPolarHBondContact O-CB 3.2Å; Q224-I228 VanDerWaalsContact O-CG1 3.27Å; Q224-I228 WeakPolarHBondContact O-CG1 3.28Å; Q224-I228 PolarHBondContact O-N 3.02Å; I225-I228 PolarHBondContact O-N 3.03Å; I228-S232 VanDerWaalsContact O-CB 3.29Å; I228-S232 WeakPolarHBondContact O-CB 3.21Å; I228-S232 PolarHBondContact O-N 2.77Å; I228-S232 PolarHBondContact O-OG 2.89Å
229	A	86.5	Confident	82.2	Confident	57 Å²	57	99.7 Å²	99.7	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-64.9	-42	178.3	0	0	0	0	0	112.4	I225 V226 L227 S232 L233	I225-A229 VanDerWaalsContact O-CB 3.31Å; I225-A229 WeakPolarHBondContact O-CB 3.11Å; I225-A229 PolarHBondContact O-N 3.17Å; V226-A229 PolarHBondContact O-N 2.98Å; L227-A229 VanDerWaalsContact C-N 3.35Å; L227-A229 PolarHBondContact O-N 3.25Å; A229-S232 PolarHBondContact O-N 3.06Å; A229-L233 WeakPolarHBondContact O-CB 3.31Å; A229-L233 PolarHBondContact O-N 2.9Å
230	T	84.3	Confident	84	Confident	75 Å²	75	98.3 Å²	98.3	46%	0.46	52%	0.523	S	S	.	.	H	α-helix	trans	-69.9	-42.4	178	49.6	0	0	0	0	112.4	V226 L227 S232 L233 V234	V226-T230 HydrophobicContact CG1-CG2 4.45Å; V226-T230 WeakPolarHBondContact O-CB 3.5Å; V226-T230 WeakPolarHBondContact O-CG2 3.21Å; V226-T230 PolarHBondContact O-N 2.74Å; V226-T230 PolarHBondContact O-OG1 3.37Å; L227-T230 WeakPolarHBondContact CA-OG1 3.44Å; L227-T230 PolarHBondContact O-N 2.88Å; L227-T230 PolarHBondContact O-OG1 3.08Å; T230-S232 VanDerWaalsContact C-N 3.34Å; T230-S232 PolarHBondContact O-N 3.23Å; T230-L233 PolarHBondContact O-N 3.06Å; T230-V234 WeakPolarHBondContact O-CG2 3.31Å; T230-V234 PolarHBondContact O-N 2.67Å
231	F	88.8	Confident	85.5	Confident	140 Å²	140	95.6 Å²	95.6	61%	0.614	52%	0.516	S	S	*	.	H	α-helix	trans	-60.9	-41.4	171.3	-91.9	-77.2	0	0	0	112.2	L227 V234 F235	L227-F231 HydrophobicContact CD2-CD2 4.35Å; L227-F231 HydrophobicContact CD2-CE2 4.12Å; L227-F231 HydrophobicContact CG-CD2 3.99Å; L227-F231 HydrophobicContact CG-CE2 4Å; L227-F231 WeakPolarHBondContact O-CB 3.22Å; L227-F231 WeakPolarHBondContact O-CD2 3.48Å; L227-F231 PolarHBondContact O-N 3.43Å; F231-V234 PolarHBondContact O-N 3.04Å; F231-F235 WeakPolarHBondContact O-CB 3.49Å; F231-F235 PolarHBondContact O-N 2.92Å
232	S	90.7	Very high	86.4	Confident	63 Å²	63	97.7 Å²	97.7	44%	0.441	52%	0.52	S	S	.	.	H	α-helix	trans	-62.3	-43	176.2	-58.5	0	0	0	0	111.8	I228 A229 T230 F235 V236	I228-S232 VanDerWaalsContact O-CB 3.29Å; I228-S232 WeakPolarHBondContact O-CB 3.21Å; I228-S232 PolarHBondContact O-N 2.77Å; I228-S232 PolarHBondContact O-OG 2.89Å; A229-S232 PolarHBondContact O-N 3.06Å; T230-S232 VanDerWaalsContact C-N 3.34Å; T230-S232 PolarHBondContact O-N 3.23Å; S232-F235 PolarHBondContact O-N 2.76Å; S232-V236 WeakPolarHBondContact O-CG2 3.47Å; S232-V236 PolarHBondContact O-N 2.82Å
233	L	90.2	Very high	87.2	Confident	117 Å²	117	96.1 Å²	96.1	61%	0.613	52%	0.515	S	S	*	.	H	α-helix	trans	-66.5	-42.1	178	-167.1	150.1	0	0	0	111.7	A229 T230 F235 V236 V237	A229-L233 WeakPolarHBondContact O-CB 3.31Å; A229-L233 PolarHBondContact O-N 2.9Å; T230-L233 PolarHBondContact O-N 3.06Å; L233-F235 VanDerWaalsContact C-N 3.34Å; L233-F235 PolarHBondContact O-N 2.93Å; L233-V236 PolarHBondContact O-N 3.47Å; L233-V237 HydrophobicContact CD2-CG2 4.18Å; L233-V237 WeakPolarHBondContact O-CG2 3.48Å; L233-V237 PolarHBondContact O-N 3.4Å
234	V	90.4	Very high	88.1	Confident	78 Å²	78	93 Å²	93	47%	0.473	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-41.9	173	171.1	0	0	0	0	111	T230 F231 V236 V237 L238	T230-V234 WeakPolarHBondContact O-CG2 3.31Å; T230-V234 PolarHBondContact O-N 2.67Å; F231-V234 PolarHBondContact O-N 3.04Å; V234-V236 PolarHBondContact O-N 3.45Å; V234-V237 PolarHBondContact O-N 2.85Å; V234-L238 HydrophobicContact CG1-CD1 3.82Å; V234-L238 HydrophobicContact CG1-CG 4.26Å; V234-L238 WeakPolarHBondContact O-CB 3.36Å; V234-L238 VanDerWaalsContact O-CG 3.31Å; V234-L238 WeakPolarHBondContact O-CG 3.44Å; V234-L238 PolarHBondContact O-N 2.81Å
235	F	91.2	Very high	88.9	Confident	146 Å²	146	91.9 Å²	91.9	64%	0.64	51%	0.509	S	S	*	.	H	α-helix	trans	-63.3	-40.5	176.7	-175.3	-94.1	0	0	0	112.6	F231 S232 L233 S239	F231-F235 WeakPolarHBondContact O-CB 3.49Å; F231-F235 PolarHBondContact O-N 2.92Å; S232-F235 PolarHBondContact O-N 2.76Å; L233-F235 VanDerWaalsContact C-N 3.34Å; L233-F235 PolarHBondContact O-N 2.93Å; F235-S239 VanDerWaalsContact O-CB 3.27Å; F235-S239 WeakPolarHBondContact O-CB 3.27Å; F235-S239 PolarHBondContact O-N 2.9Å; F235-S239 PolarHBondContact O-OG 2.97Å
236	V	92.4	Very high	89.1	Confident	82 Å²	82	89 Å²	89	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-45.3	174.2	169.4	0	0	0	0	111.1	S232 L233 V234 S239 L240	S232-V236 WeakPolarHBondContact O-CG2 3.47Å; S232-V236 PolarHBondContact O-N 2.82Å; L233-V236 PolarHBondContact O-N 3.47Å; V234-V236 PolarHBondContact O-N 3.45Å; V236-S239 PolarHBondContact O-N 2.89Å; V236-L240 HydrophobicContact CG1-CD1 3.97Å; V236-L240 WeakPolarHBondContact O-CB 3.46Å; V236-L240 WeakPolarHBondContact O-CG 3.45Å; V236-L240 PolarHBondContact O-N 3.21Å
237	V	91.7	Very high	89.3	Confident	74 Å²	74	88.7 Å²	88.7	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-45.3	177	171.8	0	0	0	0	111.4	L233 V234 S239 L240 V241	L233-V237 HydrophobicContact CD2-CG2 4.18Å; L233-V237 WeakPolarHBondContact O-CG2 3.48Å; L233-V237 PolarHBondContact O-N 3.4Å; V234-V237 PolarHBondContact O-N 2.85Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.34Å; V237-L240 PolarHBondContact O-N 3.34Å; V237-V241 WeakPolarHBondContact O-CG2 3.37Å; V237-V241 PolarHBondContact O-N 3.3Å
238	L	91.3	Very high	89.4	Confident	108 Å²	108	87.5 Å²	87.5	57%	0.565	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-38.5	176.2	-71.7	173.9	0	0	0	111.8	V234 V241 F242	V234-L238 HydrophobicContact CG1-CD1 3.82Å; V234-L238 HydrophobicContact CG1-CG 4.26Å; V234-L238 WeakPolarHBondContact O-CB 3.36Å; V234-L238 VanDerWaalsContact O-CG 3.31Å; V234-L238 WeakPolarHBondContact O-CG 3.44Å; V234-L238 PolarHBondContact O-N 2.81Å; L238-V241 PolarHBondContact O-N 3.35Å; L238-F242 VanDerWaalsContact O-CB 3.28Å; L238-F242 WeakPolarHBondContact O-CB 3.41Å; L238-F242 PolarHBondContact O-N 3.27Å
239	S	90.6	Very high	89.3	Confident	44 Å²	44	89.9 Å²	89.9	31%	0.308	50%	0.503	S	S	.	.	H	α-helix	trans	-66.1	-38.4	175.6	-62.2	0	0	0	0	112.2	F235 V236 V237 T243	F235-S239 VanDerWaalsContact O-CB 3.27Å; F235-S239 WeakPolarHBondContact O-CB 3.27Å; F235-S239 PolarHBondContact O-N 2.9Å; F235-S239 PolarHBondContact O-OG 2.97Å; V236-S239 PolarHBondContact O-N 2.89Å; V237-S239 VanDerWaalsContact C-N 3.33Å; V237-S239 PolarHBondContact O-N 3.34Å; S239-T243 WeakPolarHBondContact O-CB 3.26Å; S239-T243 WeakPolarHBondContact O-CG2 3.38Å; S239-T243 PolarHBondContact O-N 3.5Å; S239-T243 PolarHBondContact O-OG1 3.05Å
240	L	92.6	Very high	89.1	Confident	103 Å²	103	94.2 Å²	94.2	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-66.9	-41.6	173.6	-77.7	164.7	0	0	0	112	V236 V237 T243 T244	V236-L240 HydrophobicContact CG1-CD1 3.97Å; V236-L240 WeakPolarHBondContact O-CB 3.46Å; V236-L240 WeakPolarHBondContact O-CG 3.45Å; V236-L240 PolarHBondContact O-N 3.21Å; V237-L240 PolarHBondContact O-N 3.34Å; L240-T243 WeakPolarHBondContact CA-OG1 3.43Å; L240-T243 PolarHBondContact O-OG1 3.48Å; L240-T243 VanDerWaalsContact O-OG1 3.1Å; L240-T244 WeakPolarHBondContact O-CB 3.46Å; L240-T244 VanDerWaalsContact O-CG2 3.31Å; L240-T244 WeakPolarHBondContact O-CG2 3.44Å; L240-T244 PolarHBondContact O-N 3.15Å; L240-T244 PolarHBondContact O-OG1 3.3Å
241	V	91.3	Very high	89	Confident	78 Å²	78	99.9 Å²	99.9	47%	0.473	52%	0.524	S	S	.	.	H	α-helix	trans	-65.5	-43.7	174.5	173.1	0	0	0	0	110.8	V237 L238 T244 V245	V237-V241 WeakPolarHBondContact O-CG2 3.37Å; V237-V241 PolarHBondContact O-N 3.3Å; L238-V241 PolarHBondContact O-N 3.35Å; V241-T244 WeakPolarHBondContact CA-OG1 3.37Å; V241-T244 PolarHBondContact O-N 3.33Å; V241-T244 PolarHBondContact O-OG1 3.24Å; V241-V245 HydrophobicContact CG1-CG2 4.41Å; V241-V245 WeakPolarHBondContact O-CB 3.47Å; V241-V245 VanDerWaalsContact O-CG2 3.24Å; V241-V245 WeakPolarHBondContact O-CG2 3.22Å; V241-V245 PolarHBondContact O-N 2.84Å
242	F	90.3	Very high	88.4	Confident	147 Å²	147	102.4 Å²	102.4	65%	0.645	53%	0.53	S	S	*	.	H	α-helix	trans	-65.2	-45.7	178.8	-168.2	-97.6	0	0	0	111.8	L238 V245 C246	L238-F242 VanDerWaalsContact O-CB 3.28Å; L238-F242 WeakPolarHBondContact O-CB 3.41Å; L238-F242 PolarHBondContact O-N 3.27Å; F242-V245 PolarHBondContact O-N 3.4Å; F242-C246 VanDerWaalsContact CE1-SG 3.52Å; F242-C246 WeakPolarHBondContact O-CB 3.21Å; F242-C246 PolarHBondContact O-N 3.16Å; F242-C246 PolarHBondContact O-SG 3.42Å; F242-C246 VanDerWaalsContact O-SG 3.35Å
243	T	89.7	Confident	87.7	Confident	74 Å²	74	105.3 Å²	105.3	45%	0.454	54%	0.535	S	S	.	.	H	α-helix	trans	-63.8	-43.5	176.4	48.7	0	0	0	0	112.3	S239 L240 V245 C246 C247	S239-T243 WeakPolarHBondContact O-CB 3.26Å; S239-T243 WeakPolarHBondContact O-CG2 3.38Å; S239-T243 PolarHBondContact O-N 3.5Å; S239-T243 PolarHBondContact O-OG1 3.05Å; L240-T243 WeakPolarHBondContact CA-OG1 3.43Å; L240-T243 PolarHBondContact O-OG1 3.48Å; L240-T243 VanDerWaalsContact O-OG1 3.1Å; T243-V245 PolarHBondContact O-N 3.48Å; T243-C246 PolarHBondContact O-N 3.27Å; T243-C247 WeakPolarHBondContact O-CB 3.32Å; T243-C247 PolarHBondContact O-N 3.27Å; T243-C247 PolarHBondContact O-SG 3.37Å; T243-C247 VanDerWaalsContact O-SG 3.32Å
244	T	89.1	Confident	86.9	Confident	85 Å²	85	105.7 Å²	105.7	52%	0.521	53%	0.533	S	S	.	.	H	α-helix	trans	-63.8	-40.2	175.8	50.5	0	0	0	0	112.6	L240 V241 C247 A248	L240-T244 WeakPolarHBondContact O-CB 3.46Å; L240-T244 VanDerWaalsContact O-CG2 3.31Å; L240-T244 WeakPolarHBondContact O-CG2 3.44Å; L240-T244 PolarHBondContact O-N 3.15Å; L240-T244 PolarHBondContact O-OG1 3.3Å; V241-T244 WeakPolarHBondContact CA-OG1 3.37Å; V241-T244 PolarHBondContact O-N 3.33Å; V241-T244 PolarHBondContact O-OG1 3.24Å; T244-C247 PolarHBondContact O-N 3.29Å; T244-A248 WeakPolarHBondContact O-CB 3.49Å; T244-A248 PolarHBondContact O-N 2.84Å
245	V	89.2	Confident	85.9	Confident	87 Å²	87	108.1 Å²	108.1	53%	0.527	54%	0.541	S	S	.	.	H	α-helix	trans	-64.8	-43.7	173	170.5	0	0	0	0	111.4	V241 F242 T243 C247 A248 Y249	V241-V245 HydrophobicContact CG1-CG2 4.41Å; V241-V245 WeakPolarHBondContact O-CB 3.47Å; V241-V245 VanDerWaalsContact O-CG2 3.24Å; V241-V245 WeakPolarHBondContact O-CG2 3.22Å; V241-V245 PolarHBondContact O-N 2.84Å; F242-V245 PolarHBondContact O-N 3.4Å; T243-V245 PolarHBondContact O-N 3.48Å; V245-C247 PolarHBondContact O-N 3.44Å; V245-A248 PolarHBondContact O-N 3.5Å; V245-Y249 WeakPolarHBondContact O-CB 3.31Å; V245-Y249 PolarHBondContact O-N 3.17Å
246	C	87.8	Confident	84.6	Confident	48 Å²	48	105.1 Å²	105.1	32%	0.324	54%	0.535	S	S	.	.	H	α-helix	trans	-63.4	-40	175.3	-76.3	0	0	0	0	112.6	F242 T243 Y249 K250	F242-C246 VanDerWaalsContact CE1-SG 3.52Å; F242-C246 WeakPolarHBondContact O-CB 3.21Å; F242-C246 PolarHBondContact O-N 3.16Å; F242-C246 PolarHBondContact O-SG 3.42Å; F242-C246 VanDerWaalsContact O-SG 3.35Å; T243-C246 PolarHBondContact O-N 3.27Å; C246-Y249 PolarHBondContact O-N 3.06Å; C246-K250 WeakPolarHBondContact O-CB 3.39Å; C246-K250 WeakPolarHBondContact O-CG 3.42Å; C246-K250 PolarHBondContact O-N 3.41Å
247	C	87.4	Confident	83.3	Confident	80 Å²	80	109 Å²	109	54%	0.541	55%	0.545	S	S	.	.	H	α-helix	trans	-64.8	-43	173.7	-75.3	0	0	0	0	111.6	T243 T244 V245 K250 R251	T243-C247 WeakPolarHBondContact O-CB 3.32Å; T243-C247 PolarHBondContact O-N 3.27Å; T243-C247 PolarHBondContact O-SG 3.37Å; T243-C247 VanDerWaalsContact O-SG 3.32Å; T244-C247 PolarHBondContact O-N 3.29Å; V245-C247 PolarHBondContact O-N 3.44Å; C247-K250 PolarHBondContact O-N 2.93Å; C247-R251 WeakPolarHBondContact O-CB 3.48Å; C247-R251 PolarHBondContact O-N 3.24Å
248	A	84.8	Confident	81.7	Confident	51 Å²	51	110.8 Å²	110.8	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-64.2	-40.1	174.9	0	0	0	0	0	112.1	T244 V245 R251 R252	T244-A248 WeakPolarHBondContact O-CB 3.49Å; T244-A248 PolarHBondContact O-N 2.84Å; V245-A248 PolarHBondContact O-N 3.5Å; A248-R251 PolarHBondContact O-N 3.12Å; A248-R252 WeakPolarHBondContact O-CB 3.15Å; A248-R252 WeakPolarHBondContact O-CG 3.42Å; A248-R252 PolarHBondContact O-N 2.97Å
249	Y	84.1	Confident	79.8	Confident	151 Å²	151	114.5 Å²	114.5	59%	0.592	56%	0.558	S	S	*	*	H	α-helix	trans	-66	-45.6	175.2	-179	-94.1	0	0	0	111.9	V245 C246 R251 R252 K253	V245-Y249 WeakPolarHBondContact O-CB 3.31Å; V245-Y249 PolarHBondContact O-N 3.17Å; C246-Y249 PolarHBondContact O-N 3.06Å; Y249-R251 PolarHBondContact O-N 3.17Å; Y249-R252 PolarHBondContact O-N 2.99Å; Y249-K253 HydrophobicContact CE1-CD 4.2Å; Y249-K253 WeakPolarHBondContact O-CB 3.43Å; Y249-K253 PolarHBondContact O-N 2.95Å
250	K	83.3	Confident	77.8	Confident	148 Å²	148	118 Å²	118	64%	0.643	57%	0.573	S	S	*	*	H	α-helix	trans	-59.6	-45.4	173.8	-78.4	-175.3	178	-178.6	0	111.6	C246 C247 K253 Q254	C246-K250 WeakPolarHBondContact O-CB 3.39Å; C246-K250 WeakPolarHBondContact O-CG 3.42Å; C246-K250 PolarHBondContact O-N 3.41Å; C247-K250 PolarHBondContact O-N 2.93Å; K250-K253 PolarHBondContact O-N 3.25Å; K250-Q254 PolarHBondContact O-N 3.18Å
251	R	81.5	Confident	75.8	Confident	194 Å²	194	116.4 Å²	116.4	73%	0.732	57%	0.57	S	S	*	*	H	α-helix	trans	-59.9	-44.6	173.9	-89.3	-175.6	168.6	171.4	-2.4	112.5	C247 A248 Y249 Q254 M255	C247-R251 WeakPolarHBondContact O-CB 3.48Å; C247-R251 PolarHBondContact O-N 3.24Å; A248-R251 PolarHBondContact O-N 3.12Å; Y249-R251 PolarHBondContact O-N 3.17Å; R251-Q254 PolarHBondContact O-N 2.98Å; R251-M255 WeakPolarHBondContact O-CG 3.3Å; R251-M255 PolarHBondContact O-N 3.44Å
252	R	76.4	Confident	73.7	Confident	192 Å²	192	117.3 Å²	117.3	73%	0.725	58%	0.576	S	S	*	*	H	α-helix	trans	-61.3	-47.4	174.9	-78.3	-174.9	179.4	-175.6	1.6	111.3	A248 Y249 Q254 M255 T256	A248-R252 WeakPolarHBondContact O-CB 3.15Å; A248-R252 WeakPolarHBondContact O-CG 3.42Å; A248-R252 PolarHBondContact O-N 2.97Å; Y249-R252 PolarHBondContact O-N 2.99Å; R252-Q254 VanDerWaalsContact C-N 3.32Å; R252-Q254 PolarHBondContact O-N 2.83Å; R252-M255 PolarHBondContact O-N 3.39Å; R252-M255 VanDerWaalsContact O-N 3.11Å; R252-T256 PolarHBondContact O-N 3.24Å; R252-T256 PolarHBondContact O-OG1 2.91Å
253	K	76.8	Confident	71.5	Confident	125 Å²	125	117.6 Å²	117.6	54%	0.543	58%	0.581	S	S	.	*	H	α-helix	trans	-62.4	-35.4	179.1	-168.2	169	-177.1	172.2	0	112.8	Y249 K250 K257	Y249-K253 HydrophobicContact CE1-CD 4.2Å; Y249-K253 WeakPolarHBondContact O-CB 3.43Å; Y249-K253 PolarHBondContact O-N 2.95Å; K250-K253 PolarHBondContact O-N 3.25Å; K253-K257 PolarHBondContact O-N 3.28Å; K253-K257 VanDerWaalsContact O-N 3.12Å
254	Q	73.7	Confident	69.2	Low	125 Å²	125	120.7 Å²	120.7	58%	0.584	59%	0.594	S	S	*	*	H	α-helix	trans	-66.9	-45.2	170.6	-77.4	176.7	-33.8	0	0	112.1	K250 R251 R252 T256 K257 L258	K250-Q254 PolarHBondContact O-N 3.18Å; R251-Q254 PolarHBondContact O-N 2.98Å; R252-Q254 VanDerWaalsContact C-N 3.32Å; R252-Q254 PolarHBondContact O-N 2.83Å; Q254-T256 VanDerWaalsContact C-N 3.33Å; Q254-T256 PolarHBondContact O-N 2.8Å; Q254-K257 PolarHBondContact O-N 3.15Å; Q254-K257 VanDerWaalsContact O-N 3.15Å; Q254-L258 WeakPolarHBondContact O-CD1 3.35Å; Q254-L258 PolarHBondContact O-N 3.17Å
255	M	69.4	Low	66.7	Low	129 Å²	129	123.5 Å²	123.5	64%	0.635	61%	0.606	S	S	*	*	H	α-helix	trans	-62.1	-36.2	175.6	-77.8	-72.8	-179.4	0	0	112.9	R251 R252 L258 R259	R251-M255 WeakPolarHBondContact O-CG 3.3Å; R251-M255 PolarHBondContact O-N 3.44Å; R252-M255 PolarHBondContact O-N 3.39Å; R252-M255 VanDerWaalsContact O-N 3.11Å; M255-L258 PolarHBondContact O-N 3.46Å; M255-R259 WeakPolarHBondContact O-CB 3.35Å; M255-R259 WeakPolarHBondContact O-CG 3.29Å; M255-R259 PolarHBondContact O-N 3.03Å
256	T	62.1	Low	64.1	Low	83 Å²	83	128.4 Å²	128.4	51%	0.509	62%	0.621	S	S	.	*	H	α-helix	trans	-68.6	-37.1	173.6	-35.7	0	0	0	0	111.7	R252 Q254 R259 L260	R252-T256 PolarHBondContact O-N 3.24Å; R252-T256 PolarHBondContact O-OG1 2.91Å; Q254-T256 VanDerWaalsContact C-N 3.33Å; Q254-T256 PolarHBondContact O-N 2.8Å; T256-R259 PolarHBondContact O-N 3.47Å; T256-L260 HydrophobicContact CG2-CD1 4.32Å; T256-L260 PolarHBondContact O-N 2.9Å
257	K	67.1	Low	61.3	Low	163 Å²	163	135.3 Å²	135.3	71%	0.709	65%	0.648	S	S	*	*	H	α-helix	trans	-63.2	-46	172.2	-90.3	-163.7	169.2	-164.4	0	112.3	K253 Q254 R259 L260 S261	K253-K257 PolarHBondContact O-N 3.28Å; K253-K257 VanDerWaalsContact O-N 3.12Å; Q254-K257 PolarHBondContact O-N 3.15Å; Q254-K257 VanDerWaalsContact O-N 3.15Å; K257-R259 VanDerWaalsContact C-N 3.31Å; K257-R259 PolarHBondContact O-N 3.42Å; K257-L260 PolarHBondContact O-N 3.45Å; K257-S261 PolarHBondContact O-N 3.1Å; K257-S261 PolarHBondContact O-OG 3.09Å
258	L	56.8	Low	58.5	Low	112 Å²	112	136.6 Å²	136.6	59%	0.586	66%	0.658	S	S	*	*	H	α-helix	trans	-62.5	-37.6	176	-94.7	100.4	0	0	0	112.3	Q254 M255 S261 T262	Q254-L258 WeakPolarHBondContact O-CD1 3.35Å; Q254-L258 PolarHBondContact O-N 3.17Å; M255-L258 PolarHBondContact O-N 3.46Å; L258-S261 WeakPolarHBondContact CA-OG 3.43Å; L258-S261 PolarHBondContact O-N 2.7Å; L258-S261 PolarHBondContact O-OG 3.31Å; L258-T262 PolarHBondContact O-N 2.95Å; L258-T262 VanDerWaalsContact O-N 3.15Å; L258-T262 PolarHBondContact O-OG1 2.94Å; L258-T262 VanDerWaalsContact O-OG1 3.14Å
259	R	51	Low	56.1	Low	185 Å²	185	139.5 Å²	139.5	70%	0.698	68%	0.675	S	S	*	*	H	α-helix	trans	-67.8	-36.8	175.9	-78	-176.1	175.6	-177.2	-2.2	113	M255 T256 K257 T262 M263	M255-R259 WeakPolarHBondContact O-CB 3.35Å; M255-R259 WeakPolarHBondContact O-CG 3.29Å; M255-R259 PolarHBondContact O-N 3.03Å; T256-R259 PolarHBondContact O-N 3.47Å; K257-R259 VanDerWaalsContact C-N 3.31Å; K257-R259 PolarHBondContact O-N 3.42Å; R259-T262 WeakPolarHBondContact CA-OG1 3.47Å; R259-T262 PolarHBondContact O-N 2.87Å; R259-T262 PolarHBondContact O-OG1 3.28Å; R259-M263 WeakPolarHBondContact O-CG 3.31Å; R259-M263 PolarHBondContact O-N 2.85Å
260	L	50.1	Low	53.5	Low	119 Å²	119	139.4 Å²	139.4	62%	0.623	68%	0.683	S	S	*	*	H	α-helix	trans	-66.7	-39.8	173.6	-103.1	76.7	0	0	0	112.2	T256 K257 T262 M263	T256-L260 HydrophobicContact CG2-CD1 4.32Å; T256-L260 PolarHBondContact O-N 2.9Å; K257-L260 PolarHBondContact O-N 3.45Å; L260-T262 VanDerWaalsContact C-N 3.31Å; L260-T262 PolarHBondContact O-N 2.9Å; L260-M263 PolarHBondContact O-N 3.22Å
261	S	48.8	Very low	50.9	Low	69 Å²	69	139.2 Å²	139.2	48%	0.483	69%	0.687	S	S	.	*	H	α-helix	trans	-63.9	-35.4	175.2	47.6	0	0	0	0	112.6	K257 L258 M263	K257-S261 PolarHBondContact O-N 3.1Å; K257-S261 PolarHBondContact O-OG 3.09Å; L258-S261 WeakPolarHBondContact CA-OG 3.43Å; L258-S261 PolarHBondContact O-N 2.7Å; L258-S261 PolarHBondContact O-OG 3.31Å; S261-M263 VanDerWaalsContact C-N 3.3Å; S261-M263 PolarHBondContact O-N 3.48Å
262	T	47.8	Very low	48.5	Very low	96 Å²	96	138.5 Å²	138.5	59%	0.589	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-2.5	179.7	52	0	0	0	0	115.5	L258 R259 L260	L258-T262 PolarHBondContact O-N 2.95Å; L258-T262 VanDerWaalsContact O-N 3.15Å; L258-T262 PolarHBondContact O-OG1 2.94Å; L258-T262 VanDerWaalsContact O-OG1 3.14Å; R259-T262 WeakPolarHBondContact CA-OG1 3.47Å; R259-T262 PolarHBondContact O-N 2.87Å; R259-T262 PolarHBondContact O-OG1 3.28Å; L260-T262 VanDerWaalsContact C-N 3.31Å; L260-T262 PolarHBondContact O-N 2.9Å
263	M	43.9	Very low	46.1	Very low	154 Å²	154	137.1 Å²	137.1	76%	0.759	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-6.6	178.1	-64.2	-139.8	77.4	0	0	114.3	R259 L260 S261	R259-M263 WeakPolarHBondContact O-CG 3.31Å; R259-M263 PolarHBondContact O-N 2.85Å; L260-M263 PolarHBondContact O-N 3.22Å; S261-M263 VanDerWaalsContact C-N 3.3Å; S261-M263 PolarHBondContact O-N 3.48Å
264	N	42.5	Very low	44	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	71%	0.708	S	S	*	*	S	Bend	trans	-90.5	-8.5	179	-76.3	15	0	0	0	114.4
265	D	36	Very low	41.8	Very low	144 Å²	144	135 Å²	135	77%	0.77	72%	0.719	S	S	*	*	S	Bend	trans	-96.4	24	-176	-69.5	-26.1	0	0	0	114.2
266	K	33.8	Very low	39.9	Very low	190 Å²	190	133.9 Å²	133.9	83%	0.826	73%	0.731	S	S	*	*			trans	-131.3	15.7	-176.8	-76.6	-162.6	172.6	-171.1	0	117
267	E	30.4	Very low	38.3	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	75%	0.748	S	S	*	*			trans	-99.2	80.9	165.4	-71.7	-167.7	148.9	0	0	111.3
268	S	28.4	Very low	36.6	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	76%	0.756	S	S	*	*			trans	-177.7	153.6	152.3	42.6	0	0	0	0	110.8
269	S	33.2	Very low	35.1	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	77%	0.765	S	S	*	*			trans	70.9	137.8	-175	77.3	0	0	0	0	116.8
270	I	29.5	Very low	33.9	Very low	148 Å²	148	133.1 Å²	133.1	76%	0.759	77%	0.771	S	S	*	*			cis	168.2	146.1	-34.4	-96.1	164.1	0	0	0	106.6
271	M	29.6	Very low	32.7	Very low	144 Å²	144	134 Å²	134	71%	0.709	78%	0.777	S	S	*	*			trans	79.8	111	161.2	-82	-177.3	-166.4	0	0	123.8
272	K	31.7	Very low	31.7	Very low	179 Å²	179	136.4 Å²	136.4	78%	0.778	79%	0.793	S	S	*	*				103.2	126.5	114	-80.5	169.9	-177.9	171.6	0	122.7
273	L	25.8	Very low	30.7	Very low	164 Å²	164	141 Å²	141	86%	0.859	81%	0.805	S	S	*	*			trans	-68.2	-175.9	167.1	-98.4	85.1	0	0	0	113.5
274	P	32.9	Very low	29.9	Very low	125 Å²	125	138.1 Å²	138.1	81%	0.812	80%	0.801	S	S	*	*			cis	-133	-176	14.3	31.6	-7.8	0	0	0	116.2
275	G	26.2	Very low	29.1	Very low	80 Å²	80	140.2 Å²	140.2	83%	0.825	81%	0.811	S	S	*	*			trans	-117.6	-176.2	-177	0	0	0	0	0	115.7
276	A	30.6	Very low	28.9	Very low	106 Å²	106	139.8 Å²	139.8	88%	0.876	80%	0.804	S	S	*	*			trans	-149.6	151.1	168.1	0	0	0	0	0	109.4
277	E	27.2	Very low	28.5	Very low	185 Å²	185	141.4 Å²	141.4	86%	0.864	81%	0.805	S	S	*	*			trans	-88.4	147.9	-169.8	-56.6	172.7	140.9	0	0	112.8
278	T	31.9	Very low	28.3	Very low	143 Å²	143	141.8 Å²	141.8	88%	0.877	80%	0.804	S	S	*	*				160.4	139.6	125.4	39.3	0	0	0	0	112.6
279	G	26.6	Very low	28.3	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	79%	0.787	S	S	*	*			trans	76.6	109.5	140.3	0	0	0	0	0	121.2
280	C	24.2	Very low	28.3	Very low	122 Å²	122	140.1 Å²	140.1	82%	0.824	78%	0.782	S	S	*	*			trans	90.8	136.1	144.4	-129.6	0	0	0	0	121.6
281	D	26.2	Very low	28.3	Very low	138 Å²	138	142.4 Å²	142.4	74%	0.738	78%	0.781	S	S	*	*			trans	58.8	95.2	160.4	-71.5	-30.7	0	0	0	122.9	K283	D281-K283 PolarHBondContact O-N 2.77Å
282	S	26.9	Very low	28.4	Very low	119 Å²	119	139.9 Å²	139.9	83%	0.832	77%	0.77	S	S	*	*			trans	-68.5	101.2	158.1	48.7	0	0	0	0	112.5
283	K	27.1	Very low	28.4	Very low	192 Å²	192	135.1 Å²	135.1	84%	0.835	75%	0.753	S	S	*	*			trans	-167.2	43.8	169.2	-112.1	153	-164.2	168.8	0	118.4	D281	D281-K283 PolarHBondContact O-N 2.77Å
284	S	26.4	Very low	28.6	Very low	95 Å²	95	134.5 Å²	134.5	66%	0.664	74%	0.743	S	S	*	*			trans	-160.7	76.8	170.3	53.7	0	0	0	0	117.2
285	L	26.5	Very low	28.6	Very low	182 Å²	182	132.7 Å²	132.7	95%	0.953	73%	0.73	S	S	*	*			trans	-130.3	63.3	153.8	-98.4	166.9	0	0	0	111.6
286	H	31.3	Very low	28.7	Very low	135 Å²	135	133.7 Å²	133.7	63%	0.625	71%	0.714	S	S	*	*				53.6	85.5	125.2	-79.8	-97	0	0	0	120.9
287	R	26.4	Very low	28.7	Very low	223 Å²	223	133.9 Å²	133.9	84%	0.842	70%	0.697	S	S	*	*				52.4	79.9	125.7	-62.3	-179.8	-178.3	172.7	2.5	117.9
288	F	25.4	Very low	28.9	Very low	202 Å²	202	127.4 Å²	127.4	89%	0.886	67%	0.672	S	S	*	*			trans	-77.8	128.4	131.6	-96.5	-87	0	0	0	108.8
289	S	29.2	Very low	28.8	Very low	55 Å²	55	125 Å²	125	39%	0.385	66%	0.657	S	S	.	*			trans	-83.4	151.1	-166.2	83.8	0	0	0	0	112.7	R291 D292	S289-R291 PolarHBondContact O-N 3.36Å; S289-R291 WeakPolarHBondContact OG-CB 3.46Å; S289-R291 PolarHBondContact OG-N 2.87Å; S289-D292 PolarHBondContact O-N 2.87Å
290	N	31.8	Very low	29	Very low	129 Å²	129	124.5 Å²	124.5	69%	0.69	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	16.5	173.2	-112.2	-25.4	0	0	0	114.3	K294	N290-K294 WeakPolarHBondContact O-CD 3.36Å; N290-K294 WeakPolarHBondContact O-CG 3.31Å
291	R	30.5	Very low	29.3	Very low	197 Å²	197	119.9 Å²	119.9	74%	0.743	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-31.4	171.8	-67.4	-179	169.7	176.2	-3	112.1	S289 K294	S289-R291 PolarHBondContact O-N 3.36Å; S289-R291 WeakPolarHBondContact OG-CB 3.46Å; S289-R291 PolarHBondContact OG-N 2.87Å; R291-K294 WeakPolarHBondContact O-CB 3.43Å; R291-K294 PolarHBondContact O-N 2.96Å; R291-K294 VanDerWaalsContact O-N 3.11Å
292	D	32.5	Very low	29.5	Very low	90 Å²	90	119.8 Å²	119.8	48%	0.481	61%	0.605	S	S	.	*	H	α-helix	trans	-82.8	-21.8	-174.8	-53.4	-52.8	0	0	0	112.9	S289 T295	S289-D292 PolarHBondContact O-N 2.87Å; D292-T295 PolarHBondContact O-OG1 3.41Å
293	L	30.8	Very low	29.7	Very low	79 Å²	79	121.6 Å²	121.6	41%	0.414	60%	0.599	S	S	.	*	H	α-helix	trans	-74.2	-25.6	162.7	-85.8	88.4	0	0	0	112.5	T295 M296 H297	L293-T295 VanDerWaalsContact C-N 3.28Å; L293-T295 PolarHBondContact O-N 3.32Å; L293-M296 PolarHBondContact O-N 3.11Å; L293-H297 PolarHBondContact O-CD2 2.91Å; L293-H297 VanDerWaalsContact O-CD2 3.23Å; L293-H297 PolarHBondContact O-N 2.91Å
294	K	30.6	Very low	29.8	Very low	152 Å²	152	118.8 Å²	118.8	66%	0.661	59%	0.588	S	S	*	*	H	α-helix	trans	-71.4	-21.5	-178.7	-80.1	178.9	178	-179	0	113	N290 R291 S298	N290-K294 WeakPolarHBondContact O-CD 3.36Å; N290-K294 WeakPolarHBondContact O-CG 3.31Å; R291-K294 WeakPolarHBondContact O-CB 3.43Å; R291-K294 PolarHBondContact O-N 2.96Å; R291-K294 VanDerWaalsContact O-N 3.11Å; K294-S298 WeakPolarHBondContact O-CB 3.46Å; K294-S298 PolarHBondContact O-N 3.08Å
295	T	31.3	Very low	29.9	Very low	86 Å²	86	122.2 Å²	122.2	53%	0.528	59%	0.591	S	S	.	*	H	α-helix	trans	-74.3	-39.4	174.3	53.8	0	0	0	0	111.8	D292 L293 S298	D292-T295 PolarHBondContact O-OG1 3.41Å; L293-T295 VanDerWaalsContact C-N 3.28Å; L293-T295 PolarHBondContact O-N 3.32Å; T295-S298 WeakPolarHBondContact O-CA 3.24Å; T295-S298 VanDerWaalsContact O-CB 3.28Å; T295-S298 WeakPolarHBondContact O-CB 3.31Å; T295-S298 PolarHBondContact O-N 3.26Å; T295-S298 VanDerWaalsContact O-N 3.09Å; T295-S298 PolarHBondContact O-OG 3.48Å
296	M	28.9	Very low	30.1	Very low	101 Å²	101	118.7 Å²	118.7	50%	0.498	57%	0.573	S	S	.	*	H	α-helix	trans	-73.8	-37.5	173.3	-75	-171.1	164.8	0	0	113.1	L293 S298 T299 S300 P574	L293-M296 PolarHBondContact O-N 3.11Å; M296-S298 PolarHBondContact O-N 2.64Å; M296-T299 PolarHBondContact O-N 2.97Å; M296-T299 PolarHBondContact O-OG1 3.19Å; M296-S300 PolarHBondContact O-N 2.95Å; M296-P574 HydrophobicContact CE-CB 4.31Å; M296-P574 HydrophobicContact SD-CB 4.38Å
297	H	32.1	Very low	29.9	Very low	110 Å²	110	120.2 Å²	120.2	51%	0.509	57%	0.574	S	S	.	*	H	α-helix	trans	-63	-21.1	165.5	-76.1	-65.1	0	0	0	112	L293 T299 A301	L293-H297 PolarHBondContact O-CD2 2.91Å; L293-H297 VanDerWaalsContact O-CD2 3.23Å; L293-H297 PolarHBondContact O-N 2.91Å; H297-T299 VanDerWaalsContact C-N 3.35Å; H297-A301 WeakPolarHBondContact O-CA 3.17Å; H297-A301 WeakPolarHBondContact O-CB 3.41Å; H297-A301 PolarHBondContact O-N 3.18Å
298	S	30.1	Very low	29.9	Very low	49 Å²	49	118 Å²	118	34%	0.343	57%	0.571	S	S	.	*	H	α-helix	trans	-74.2	-20.5	176.2	89.2	0	0	0	0	113.9	K294 T295 M296 K302	K294-S298 WeakPolarHBondContact O-CB 3.46Å; K294-S298 PolarHBondContact O-N 3.08Å; T295-S298 WeakPolarHBondContact O-CA 3.24Å; T295-S298 VanDerWaalsContact O-CB 3.28Å; T295-S298 WeakPolarHBondContact O-CB 3.31Å; T295-S298 PolarHBondContact O-N 3.26Å; T295-S298 VanDerWaalsContact O-N 3.09Å; T295-S298 PolarHBondContact O-OG 3.48Å; M296-S298 PolarHBondContact O-N 2.64Å; S298-K302 WeakPolarHBondContact O-CB 3.44Å; S298-K302 WeakPolarHBondContact O-CD 3.14Å; S298-K302 WeakPolarHBondContact O-CG 3.15Å; S298-K302 PolarHBondContact O-N 3.15Å
299	T	29.4	Very low	30.2	Very low	93 Å²	93	112.5 Å²	112.5	57%	0.571	55%	0.554	S	S	*	*	H	α-helix	trans	-85	-51.4	172.7	41.4	0	0	0	0	111	M296 H297 K302 F303	M296-T299 PolarHBondContact O-N 2.97Å; M296-T299 PolarHBondContact O-OG1 3.19Å; H297-T299 VanDerWaalsContact C-N 3.35Å; T299-K302 PolarHBondContact O-N 2.88Å; T299-F303 WeakPolarHBondContact O-CD2 3.38Å; T299-F303 PolarHBondContact O-N 3.43Å
300	S	31	Very low	30.3	Very low	65 Å²	65	119 Å²	119	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-68.3	-41.3	178.4	83.2	0	0	0	0	112.9	M296 F303 E304	M296-S300 PolarHBondContact O-N 2.95Å; S300-F303 WeakPolarHBondContact O-CB 2.98Å; S300-F303 PolarHBondContact O-N 2.94Å; S300-E304 PolarHBondContact O-N 3.14Å
301	A	31.1	Very low	30.2	Very low	26 Å²	26	117.3 Å²	117.3	22%	0.215	57%	0.566	C	S	.	*	H	α-helix	trans	-86.2	-1.7	179.2	0	0	0	0	0	113.9	H297 K305	H297-A301 WeakPolarHBondContact O-CA 3.17Å; H297-A301 WeakPolarHBondContact O-CB 3.41Å; H297-A301 PolarHBondContact O-N 3.18Å; A301-K305 WeakPolarHBondContact O-CB 3.35Å; A301-K305 VanDerWaalsContact O-CG 3.31Å; A301-K305 WeakPolarHBondContact O-CG 3.32Å; A301-K305 PolarHBondContact O-N 3.03Å
302	K	30.7	Very low	30.2	Very low	135 Å²	135	111.8 Å²	111.8	59%	0.587	57%	0.57	S	S	*	*	H	α-helix	trans	-72.3	-39.1	157.8	-92.5	175.8	-175.8	174.9	0	110.5	S298 T299 K305 L306	S298-K302 WeakPolarHBondContact O-CB 3.44Å; S298-K302 WeakPolarHBondContact O-CD 3.14Å; S298-K302 WeakPolarHBondContact O-CG 3.15Å; S298-K302 PolarHBondContact O-N 3.15Å; T299-K302 PolarHBondContact O-N 2.88Å; K302-K305 PolarHBondContact O-N 3.22Å; K302-L306 WeakPolarHBondContact O-CB 3.3Å; K302-L306 WeakPolarHBondContact O-CD1 3.34Å; K302-L306 VanDerWaalsContact O-CG 3.23Å; K302-L306 WeakPolarHBondContact O-CG 3.38Å; K302-L306 PolarHBondContact O-N 2.91Å
303	F	30.6	Very low	30	Very low	157 Å²	157	112.5 Å²	112.5	69%	0.689	58%	0.582	S	S	*	*	H	α-helix	trans	-62.3	-43	172.2	-80.9	-80	0	0	0	111.5	T299 S300	T299-F303 WeakPolarHBondContact O-CD2 3.38Å; T299-F303 PolarHBondContact O-N 3.43Å; S300-F303 WeakPolarHBondContact O-CB 2.98Å; S300-F303 PolarHBondContact O-N 2.94Å
304	E	30	Very low	29.8	Very low	133 Å²	133	112.4 Å²	112.4	62%	0.621	59%	0.588	S	S	*	*	H	α-helix	trans	-71.3	-28.2	175.4	-66.5	179.9	118	0	0	114.9	S300	S300-E304 PolarHBondContact O-N 3.14Å
305	K	28.9	Very low	29.7	Very low	167 Å²	167	109.9 Å²	109.9	73%	0.726	59%	0.588	S	S	*	*	H	α-helix	trans	-86.8	-15.8	178.9	-77.3	-178.1	174.3	178.5	0	114.7	A301 K302 Y307	A301-K305 WeakPolarHBondContact O-CB 3.35Å; A301-K305 VanDerWaalsContact O-CG 3.31Å; A301-K305 WeakPolarHBondContact O-CG 3.32Å; A301-K305 PolarHBondContact O-N 3.03Å; K302-K305 PolarHBondContact O-N 3.22Å; K305-Y307 PolarHBondContact O-N 3.44Å
306	L	29.5	Very low	29.6	Very low	108 Å²	108	113 Å²	113	57%	0.565	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-13.6	175.1	-77.9	166	0	0	0	113.3	K302	K302-L306 WeakPolarHBondContact O-CB 3.3Å; K302-L306 WeakPolarHBondContact O-CD1 3.34Å; K302-L306 VanDerWaalsContact O-CG 3.23Å; K302-L306 WeakPolarHBondContact O-CG 3.38Å; K302-L306 PolarHBondContact O-N 2.91Å
307	Y	27.8	Very low	29.7	Very low	167 Å²	167	112.7 Å²	112.7	66%	0.655	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	15.6	176.9	-77.3	-83.7	0	0	0	114.5	K305	K305-Y307 PolarHBondContact O-N 3.44Å
308	K	26.5	Very low	29.4	Very low	177 Å²	177	114.8 Å²	114.8	77%	0.77	61%	0.614	S	S	*	*			trans	-127.9	78.4	175.3	-67.8	-174.6	179.5	178.5	0	111.5
309	T	30.4	Very low	29.3	Very low	86 Å²	86	116.6 Å²	116.6	53%	0.528	62%	0.619	S	S	.	*			trans	-71.4	145.5	163.3	52.2	0	0	0	0	109.8	V28 D311	V28-T309 HydrophobicContact CG2-CG2 4.23Å; T309-D311 PolarHBondContact O-N 3.42Å; T309-D311 VanDerWaalsContact O-N 3.11Å
310	K	32	Very low	29.3	Very low	193 Å²	193	116 Å²	116	84%	0.839	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-6.8	-165.7	-83.3	-177.9	171.2	179.7	0	116
311	D	29.6	Very low	29.2	Very low	93 Å²	93	118.2 Å²	118.2	50%	0.497	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-120	14.9	-161.9	-48.1	-39.6	0	0	0	113.6	N31 T309 S313	N31-D311 PolarHBondContact ND2-OD1 2.91Å; N31-D311 PolarHBondContact ND2-OD2 2.89Å; T309-D311 PolarHBondContact O-N 3.42Å; T309-D311 VanDerWaalsContact O-N 3.11Å; D311-S313 VanDerWaalsContact C-N 3.31Å; D311-S313 PolarHBondContact O-N 2.94Å
312	G	30.5	Very low	28.9	Very low	80 Å²	80	120.9 Å²	120.9	83%	0.825	63%	0.632	S	S	*	*			trans	68.9	3.8	155.7	0	0	0	0	0	119.4
313	S	27.7	Very low	28.9	Very low	105 Å²	105	118.4 Å²	118.4	73%	0.734	63%	0.629	S	S	*	*			trans	-146.6	117.6	-179.8	65.1	0	0	0	0	114.6	D311	D311-S313 VanDerWaalsContact C-N 3.31Å; D311-S313 PolarHBondContact O-N 2.94Å
314	S	28.2	Very low	28.9	Very low	77 Å²	77	118.4 Å²	118.4	54%	0.538	63%	0.631	S	S	.	*			trans	-147.2	120.2	156.2	-177.8	0	0	0	0	108.4
315	P	27.3	Very low	28.8	Very low	100 Å²	100	118 Å²	118	65%	0.649	63%	0.633	S	S	*	*			trans	-81.3	162.9	-176.5	32.7	-34.4	0	0	0	113
316	H	29.1	Very low	28.9	Very low	152 Å²	152	118 Å²	118	70%	0.704	63%	0.633	S	S	*	*	S	Bend	trans	70.4	106	-171.3	-47.9	-84.8	0	0	0	113.8
317	T	30.8	Very low	28.6	Very low	94 Å²	94	115.3 Å²	115.3	58%	0.577	63%	0.631	S	S	*	*			cis	-127.9	120.7	5.4	35.1	0	0	0	0	112	L319 T320	T317-L319 PolarHBondContact O-N 2.98Å; T317-T320 PolarHBondContact O-N 3.3Å; T317-T320 PolarHBondContact OG1-OG1 3.5Å
318	L	26.2	Very low	28.5	Very low	154 Å²	154	112.5 Å²	112.5	81%	0.806	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	11.2	-179.8	-87.8	160.2	0	0	0	116.3
319	L	27.3	Very low	28.4	Very low	86 Å²	86	107.2 Å²	107.2	45%	0.45	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.3	-14.5	-179.7	-142.9	76.7	0	0	0	113.5	T317 L322	T317-L319 PolarHBondContact O-N 2.98Å; L319-L322 HydrophobicContact CD1-CD1 3.79Å; L319-L322 HydrophobicContact CG-CD1 4.29Å
320	T	30.2	Very low	28.1	Very low	80 Å²	80	110.2 Å²	110.2	49%	0.491	65%	0.65	S	S	.	*	S	Bend	trans	-82.3	-20	-178.3	-33.8	0	0	0	0	112.8	T317 T323	T317-T320 PolarHBondContact O-N 3.3Å; T317-T320 PolarHBondContact OG1-OG1 3.5Å; T320-T323 PolarHBondContact O-OG1 2.97Å
321	D	27.8	Very low	27.9	Very low	112 Å²	112	107.2 Å²	107.2	60%	0.599	65%	0.647	S	S	*	*	S	Bend	trans	-78.9	-18.7	174.5	-67.5	-38.8	0	0	0	113	T323 H324	D321-T323 VanDerWaalsContact C-N 3.32Å; D321-T323 PolarHBondContact O-N 2.85Å; D321-H324 PolarHBondContact O-N 2.9Å
322	L	26.5	Very low	27.7	Very low	82 Å²	82	108.8 Å²	108.8	43%	0.429	66%	0.661	S	S	.	*	H	α-helix	trans	-66.7	-33.4	176.6	-71.7	172.9	0	0	0	112.1	L319 H324 N325 F326	L319-L322 HydrophobicContact CD1-CD1 3.79Å; L319-L322 HydrophobicContact CG-CD1 4.29Å; L322-H324 PolarHBondContact O-N 3.42Å; L322-H324 VanDerWaalsContact O-N 3.15Å; L322-N325 PolarHBondContact O-N 3.32Å; L322-N325 VanDerWaalsContact O-N 3.16Å; L322-F326 PolarHBondContact O-N 3.21Å
323	T	30.7	Very low	27.3	Very low	83 Å²	83	114.8 Å²	114.8	51%	0.509	66%	0.66	S	S	.	*	H	α-helix	trans	-66.1	-12.3	175.3	35.1	0	0	0	0	114.3	T320 D321 W422	T320-T323 PolarHBondContact O-OG1 2.97Å; D321-T323 VanDerWaalsContact C-N 3.32Å; D321-T323 PolarHBondContact O-N 2.85Å; T323-W422 HydrophobicContact CG2-CZ2 3.8Å
324	H	30.4	Very low	27.1	Very low	158 Å²	158	121 Å²	121	73%	0.731	67%	0.667	S	S	*	*	H	α-helix	trans	-96.2	-16.6	174.1	-114.2	-67.9	0	0	0	114.2	D321 L322	D321-H324 PolarHBondContact O-N 2.9Å; L322-H324 PolarHBondContact O-N 3.42Å; L322-H324 VanDerWaalsContact O-N 3.15Å
325	N	28.3	Very low	26.9	Very low	125 Å²	125	122.3 Å²	122.3	67%	0.668	68%	0.682	S	S	*	*	H	α-helix	trans	-103.3	-10.6	-173.7	-75.7	-21.9	0	0	0	114.9	L322 G327	L322-N325 PolarHBondContact O-N 3.32Å; L322-N325 VanDerWaalsContact O-N 3.16Å; N325-G327 VanDerWaalsContact C-N 3.31Å
326	F	29	Very low	26.8	Very low	167 Å²	167	122 Å²	122	73%	0.732	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-0.8	173.7	-88.7	-80.8	0	0	0	114.6	L322	L322-F326 PolarHBondContact O-N 3.21Å
327	G	25.1	Very low	26.6	Very low	50 Å²	50	121.5 Å²	121.5	52%	0.515	69%	0.685	S	S	.	*	T	Hydrogen-bonded Turn	trans	-108.9	6.3	-175.7	0	0	0	0	0	116.3	N325	N325-G327 VanDerWaalsContact C-N 3.31Å
328	S	24.9	Very low	26.5	Very low	108 Å²	108	123.9 Å²	123.9	76%	0.755	69%	0.694	S	S	*	*	S	Bend	trans	-162.5	91.4	-179.6	179.4	0	0	0	0	112.1
329	G	25.1	Very low	26.7	Very low	66 Å²	66	124.7 Å²	124.7	68%	0.68	70%	0.699	S	S	*	*			trans	168.5	105.2	173.4	0	0	0	0	0	113.2	V331	G329-V331 PolarHBondContact O-N 3.23Å
330	T	24	Very low	26.7	Very low	149 Å²	149	129.4 Å²	129.4	91%	0.914	72%	0.723	S	S	*	*			trans	-61.9	96.6	166.7	47.5	0	0	0	0	110.1
331	V	26.2	Very low	26.6	Very low	130 Å²	130	129.7 Å²	129.7	79%	0.788	73%	0.729	S	S	*	*			trans	-111	107.9	169.3	-178.1	0	0	0	0	108	G329	G329-V331 PolarHBondContact O-N 3.23Å
332	T	25.5	Very low	26.6	Very low	126 Å²	126	131.3 Å²	131.3	77%	0.773	73%	0.732	S	S	*	*			trans	-63.7	135	179.7	36	0	0	0	0	111.5	R334	T332-R334 PolarHBondContact O-N 3.01Å
333	Y	23.6	Very low	26.6	Very low	206 Å²	206	134.4 Å²	134.4	81%	0.808	75%	0.749	S	S	*	*	S	Bend	trans	-59.3	99.1	169.1	-84.2	-100.7	0	0	0	110.3
334	R	22.5	Very low	26.5	Very low	237 Å²	237	139 Å²	139	89%	0.894	76%	0.762	S	S	*	*			trans	-165.6	44.7	169.5	-112.2	170.7	-155.8	-166.7	6.1	113.6	T332	T332-R334 PolarHBondContact O-N 3.01Å
335	A	24.6	Very low	26.4	Very low	103 Å²	103	140.8 Å²	140.8	85%	0.851	77%	0.768	S	S	*	*			trans	-159.6	38.6	170.2	0	0	0	0	0	113.2
336	S	24.6	Very low	26.2	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	77%	0.77	S	S	*	*			trans	-79.6	156.4	163.4	47.1	0	0	0	0	110
337	D	25.7	Very low	26.1	Very low	142 Å²	142	142 Å²	142	76%	0.759	78%	0.776	S	S	*	*	S	Bend	trans	71.9	93.7	176.9	-43.7	-32.9	0	0	0	115.3
338	N	29.4	Very low	26.1	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	79%	0.793	S	S	*	*	S	Bend	trans	162.2	-11.9	138.9	-85.3	-43.8	0	0	0	115.1	S341	N338-S341 PolarHBondContact O-OG 3.39Å
339	L	28.5	Very low	26.2	Very low	172 Å²	172	146.8 Å²	146.8	90%	0.901	78%	0.779	S	S	*	*	S	Bend	trans	-97.5	-6.9	-173.9	-93.8	153.6	0	0	0	116.1
340	L	28.8	Very low	26.8	Very low	184 Å²	184	148 Å²	148	96%	0.963	78%	0.775	S	S	*	*	S	Bend	trans	-92.5	-1.3	178	-82.5	159.5	0	0	0	114.2
341	S	27.3	Very low	27.7	Very low	87 Å²	87	148.5 Å²	148.5	61%	0.608	77%	0.767	S	S	*	*	S	Bend	trans	-93.2	-5	-176	56.4	0	0	0	0	114.8	N338	N338-S341 PolarHBondContact O-OG 3.39Å
342	Q	27.8	Very low	29.4	Very low	145 Å²	145	143.8 Å²	143.8	68%	0.678	74%	0.738	S	S	*	*			trans	-103.3	104.1	-179	-65.3	-162.5	5.6	0	0	112.5	K344	Q342-K344 PolarHBondContact O-N 3.45Å
343	N	26.8	Very low	31.7	Very low	147 Å²	147	139.4 Å²	139.4	79%	0.786	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	46.1	176.8	-78.5	-35.5	0	0	0	114.9
344	K	28.6	Very low	33.9	Very low	179 Å²	179	129.7 Å²	129.7	78%	0.778	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	-0.3	-173.8	-76.5	-174.7	174.1	178.2	0	116.2	Q342	Q342-K344 PolarHBondContact O-N 3.45Å
345	F	28	Very low	36.3	Very low	197 Å²	197	126.2 Å²	126.2	86%	0.864	66%	0.66	S	S	*	*	S	Bend	trans	-114.4	8.7	178.3	-84.5	-81.2	0	0	0	115.3	H347	F345-H347 PolarHBondContact O-N 3.19Å; F345-H347 VanDerWaalsContact O-N 3.09Å
346	L	24.7	Very low	38.8	Very low	132 Å²	132	123.6 Å²	123.6	69%	0.691	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-6.3	-170.5	-126.8	85.6	0	0	0	116.2
347	H	27	Very low	41.7	Very low	186 Å²	186	119.6 Å²	119.6	86%	0.861	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	3.3	-163.1	-103.1	-75.5	0	0	0	117.1	F345	F345-H347 PolarHBondContact O-N 3.19Å; F345-H347 VanDerWaalsContact O-N 3.09Å
348	L	25.3	Very low	44.6	Very low	169 Å²	169	116.2 Å²	116.2	89%	0.885	59%	0.586	S	S	*	*			trans	-133.1	35.6	-175.7	-77.2	170.4	0	0	0	114.1
349	I	27.2	Very low	47.5	Very low	89 Å²	89	109.5 Å²	109.5	46%	0.456	55%	0.551	S	S	.	*			trans	-84.1	126.5	177.2	-43.9	175.5	0	0	0	110.2	Q351	I349-Q351 PolarHBondContact O-N 3.16Å
350	P	36	Very low	50.3	Low	91 Å²	91	104.5 Å²	104.5	59%	0.591	52%	0.523	S	S	*	.			trans	-56.8	138.7	174.2	-24.4	34.1	0	0	0	112.1	T352	P350-T352 PolarHBondContact O-N 3.21Å
351	Q	44.5	Very low	53.1	Low	160 Å²	160	99.9 Å²	99.9	75%	0.748	50%	0.499	S	S	*	.			trans	-70.5	94.4	170.3	-67.6	-171.2	9.4	0	0	109.7	I349	I349-Q351 PolarHBondContact O-N 3.16Å
352	T	62.2	Low	56	Low	31 Å²	31	96 Å²	96	19%	0.19	47%	0.471	C	S	.	.			trans	-73.3	150.1	171.3	70.4	0	0	0	0	109.7	P350 G354 R355 Q356 D421	P350-T352 PolarHBondContact O-N 3.21Å; T352-G354 PolarHBondContact O-N 2.81Å; T352-R355 PolarHBondContact O-N 3.01Å; T352-R355 VanDerWaalsContact O-N 3.07Å; T352-R355 WeakPolarHBondContact OG1-CG 3.47Å; T352-R355 PolarHBondContact OG1-N 3.12Å; T352-Q356 PolarHBondContact O-N 3.42Å; T352-D421 VanDerWaalsContact CB-OD2 3.24Å; T352-D421 WeakPolarHBondContact CB-OD2 3.38Å
353	V	72.4	Confident	58.8	Low	34 Å²	34	94.2 Å²	94.2	21%	0.206	47%	0.466	C	S	.	.	H	α-helix	trans	-60.5	-37.7	176.7	175.5	0	0	0	0	110.6	R355 Q356 I357 W376 A419 D421 V453	V353-R355 PolarHBondContact O-N 3.14Å; V353-Q356 WeakPolarHBondContact O-CA 3.38Å; V353-Q356 PolarHBondContact O-N 3.02Å; V353-I357 HydrophobicContact CG1-CD1 3.62Å; V353-I357 HydrophobicContact CG1-CG1 4.16Å; V353-I357 WeakPolarHBondContact O-CG1 3.27Å; V353-I357 PolarHBondContact O-N 3.38Å; V353-I357 VanDerWaalsContact O-N 3.17Å; V353-W376 HydrophobicContact CG1-CD2 4.32Å; V353-W376 HydrophobicContact CG1-CZ2 3.85Å; V353-W376 HydrophobicContact CG2-CZ2 3.92Å; V353-A419 HydrophobicContact CB-CB 4.29Å; V353-A419 HydrophobicContact CG1-CB 3.68Å; V353-A419 HydrophobicContact CG2-CB 4.27Å; V353-D421 WeakPolarHBondContact CA-OD2 3.47Å; V353-D421 WeakPolarHBondContact CB-OD2 3.46Å; V353-D421 PolarHBondContact N-OD2 3.06Å; V353-V453 HydrophobicContact CG1-CG2 4.47Å
354	G	70.1	Confident	61.5	Low	1 Å²	1	88.7 Å²	88.7	1%	0.01	44%	0.444	C	S	.	.	H	α-helix	trans	-57.2	-29.1	174.3	0	0	0	0	0	113.8	T352 D421	T352-G354 PolarHBondContact O-N 2.81Å; G354-D421 PolarHBondContact N-OD2 2.77Å
355	R	72.7	Confident	63.9	Low	164 Å²	164	83.9 Å²	83.9	62%	0.619	43%	0.429	S	S	*	.	H	α-helix	trans	-85.1	-15.7	173.3	-71.9	179	174.9	-150.6	-1.5	114.2	T352 V353	T352-R355 PolarHBondContact O-N 3.01Å; T352-R355 VanDerWaalsContact O-N 3.07Å; T352-R355 WeakPolarHBondContact OG1-CG 3.47Å; T352-R355 PolarHBondContact OG1-N 3.12Å; V353-R355 PolarHBondContact O-N 3.14Å
356	Q	78.5	Confident	66.1	Low	49 Å²	49	76.7 Å²	76.7	23%	0.229	41%	0.41	C	S	.	.	H	α-helix	trans	-92.1	-5.5	175.9	-67	-174.8	-6.3	0	0	113	T352 V353 R377	T352-Q356 PolarHBondContact O-N 3.42Å; V353-Q356 WeakPolarHBondContact O-CA 3.38Å; V353-Q356 PolarHBondContact O-N 3.02Å; Q356-R377 VanDerWaalsContact OE1-NH2 3.08Å
357	I	83.6	Confident	68.5	Low	9 Å²	9	77.2 Å²	77.2	5%	0.046	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	126.1	-178.3	-70.9	174.9	0	0	0	110.1	V353 L359 T375 W376 L451 V453	V353-I357 HydrophobicContact CG1-CD1 3.62Å; V353-I357 HydrophobicContact CG1-CG1 4.16Å; V353-I357 WeakPolarHBondContact O-CG1 3.27Å; V353-I357 PolarHBondContact O-N 3.38Å; V353-I357 VanDerWaalsContact O-N 3.17Å; I357-L359 HydrophobicContact CG2-CD2 3.73Å; I357-T375 WeakPolarHBondContact CA-O 3.24Å; I357-W376 HydrophobicContact CD1-CB 4.45Å; I357-W376 HydrophobicContact CD1-CG 4.32Å; I357-W376 HydrophobicContact CG1-CB 3.85Å; I357-W376 HydrophobicContact CG1-CG 3.79Å; I357-L451 HydrophobicContact CD1-CD2 4.36Å; I357-V453 HydrophobicContact CD1-CB 4.1Å; I357-V453 HydrophobicContact CD1-CG1 3.64Å; I357-V453 HydrophobicContact CD1-CG2 3.3Å
358	T	88.1	Confident	71.1	Confident	70 Å²	70	70.1 Å²	70.1	43%	0.429	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	117.7	168.5	-54.3	0	0	0	0	107.9	G374 T375 M429	T358-G374 CarbonylContact O-C 3.59Å; T358-G374 WeakPolarHBondContact O-CA 3.37Å; T358-T375 PolarHBondContact N-O 3.36Å; T358-T375 PolarHBondContact O-N 2.9Å; T358-M429 HydrophobicContact CG2-CE 4.3Å
359	L	89.3	Confident	74	Confident	4 Å²	4	62.6 Å²	62.6	2%	0.021	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	131.2	170.3	-55.3	-176.3	0	0	0	108.7	I357 W372 A383 L385 L423	I357-L359 HydrophobicContact CG2-CD2 3.73Å; L359-W372 HydrophobicContact CB-CD2 4.23Å; L359-W372 HydrophobicContact CB-CE3 3.81Å; L359-W372 HydrophobicContact CB-CZ3 4.43Å; L359-W372 HydrophobicContact CD1-CD2 4.2Å; L359-W372 HydrophobicContact CD1-CG 4.16Å; L359-W372 HydrophobicContact CD2-CB 4.08Å; L359-A383 HydrophobicContact CD2-CB 3.43Å; L359-A383 VanDerWaalsContact CD2-CB 3.43Å; L359-L385 HydrophobicContact CD1-CD1 3.75Å; L359-L423 HydrophobicContact CD1-CD2 3.78Å; L359-L423 HydrophobicContact CG-CD2 4.49Å
360	E	87.9	Confident	76.9	Confident	67 Å²	67	58.6 Å²	58.6	31%	0.313	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-58.6	-168.8	-69.8	172.3	179.3	0	0	111.8	S373 T375 I433	E360-S373 PolarHBondContact N-O 3.16Å; E360-T375 WeakPolarHBondContact OE1-CB 3.46Å; E360-T375 WeakPolarHBondContact OE1-CG2 2.97Å; E360-T375 PolarHBondContact OE1-OG1 2.83Å; E360-I433 WeakPolarHBondContact O-CD1 3.43Å
361	N	87.7	Confident	79.5	Confident	87 Å²	87	55.6 Å²	55.6	47%	0.465	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	139	-179.3	-61.9	-68.2	0	0	0	110.6	L363 W372 S373	N361-L363 PolarHBondContact O-N 2.97Å; N361-W372 VanDerWaalsContact C-CE3 3.42Å; N361-W372 CarbonylContact O-C 3.5Å; N361-W372 VanDerWaalsContact O-CA 3.27Å; N361-W372 WeakPolarHBondContact O-CA 3.37Å; N361-S373 PolarHBondContact N-O 2.99Å; N361-S373 PolarHBondContact N-OG 3.07Å; N361-S373 PolarHBondContact O-N 2.85Å
362	L	87.7	Confident	81.8	Confident	6 Å²	6	48 Å²	48	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	113.5	167	-180	68.4	0	0	0	108.2	T365 D370 W372 I433 L434 Y437 F438	L362-T365 HydrophobicContact CD1-CG2 4.16Å; L362-T365 HydrophobicContact CD2-CG2 4.23Å; L362-D370 HydrophobicContact CD1-CB 4.02Å; L362-W372 HydrophobicContact CB-CD2 4.25Å; L362-W372 HydrophobicContact CB-CE3 4.28Å; L362-W372 HydrophobicContact CB-CH2 4.05Å; L362-W372 HydrophobicContact CB-CZ2 4.01Å; L362-W372 HydrophobicContact CB-CZ3 4.2Å; L362-W372 HydrophobicContact CD1-CD2 4.19Å; L362-W372 HydrophobicContact CD1-CG 4.37Å; L362-W372 HydrophobicContact CD1-CZ2 3.97Å; L362-W372 HydrophobicContact CG-CZ2 4.46Å; L362-I433 HydrophobicContact CB-CG2 4.43Å; L362-L434 HydrophobicContact CD2-CD2 4.39Å; L362-Y437 HydrophobicContact CB-CD2 4.16Å; L362-Y437 HydrophobicContact CB-CE2 3.97Å; L362-Y437 HydrophobicContact CD2-CD1 4.44Å; L362-Y437 HydrophobicContact CD2-CD2 3.92Å; L362-Y437 HydrophobicContact CD2-CG 3.89Å; L362-Y437 PolarHBondContact O-OH 3.47Å; L362-F438 HydrophobicContact CD2-CE2 4.05Å
363	L	86.9	Confident	83.3	Confident	107 Å²	107	47.6 Å²	47.6	56%	0.56	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	-29.8	178.2	-63	176.3	0	0	0	111.7	N361 V371 V382	N361-L363 PolarHBondContact O-N 2.97Å; L363-V371 HydrophobicContact CB-CG1 4.41Å; L363-V371 WeakPolarHBondContact CB-O 3.29Å; L363-V371 HydrophobicContact CD1-CG1 4.32Å; L363-V371 PolarHBondContact N-O 3.33Å; L363-V382 HydrophobicContact CD1-CG2 4.48Å
364	G	82.8	Confident	84.1	Confident	31 Å²	31	46 Å²	46	32%	0.32	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	168.3	166.6	174.2	0	0	0	0	0	112.8	V371	G364-V371 PolarHBondContact N-O 2.95Å; G364-V371 PolarHBondContact O-N 2.94Å
365	T	79.2	Confident	85.1	Confident	77 Å²	77	47.5 Å²	47.5	47%	0.472	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.3	175.4	51.4	0	0	0	0	110.9	L362 D370 F438	L362-T365 HydrophobicContact CD1-CG2 4.16Å; L362-T365 HydrophobicContact CD2-CG2 4.23Å; T365-D370 HydrophobicContact CG2-CB 4.23Å; T365-D370 VanDerWaalsContact CG2-OD1 3.22Å; T365-D370 WeakPolarHBondContact CG2-OD1 3.33Å; T365-F438 HydrophobicContact CG2-CZ 3.77Å
366	G	73.4	Confident	85.7	Confident	46 Å²	46	41.1 Å²	41.1	47%	0.474	23%	0.23	S	C	.	.			trans	-104.1	173.5	178.4	0	0	0	0	0	112.4	F368 S369	G366-F368 PolarHBondContact O-N 3.44Å; G366-F368 VanDerWaalsContact O-N 3.08Å; G366-S369 PolarHBondContact N-O 3.03Å
367	R	75.3	Confident	85.8	Confident	143 Å²	143	46.5 Å²	46.5	54%	0.54	25%	0.248	S	C	.	.	S	Bend	trans	-55.7	-26.4	178.1	-177.1	176.2	173.4	173.2	-1.1	114.2
368	F	82	Confident	85.6	Confident	37 Å²	37	49.3 Å²	49.3	16%	0.162	28%	0.279	C	S	.	.	S	Bend	trans	-122.5	-20.6	-173.7	-48.5	-64.6	0	0	0	114.4	G366 F386 I392 I393 I396 L564 I670	G366-F368 PolarHBondContact O-N 3.44Å; G366-F368 VanDerWaalsContact O-N 3.08Å; F368-F386 HydrophobicContact CB-CE1 4.39Å; F368-F386 WeakPolarHBondContact O-CD1 3.48Å; F368-I392 HydrophobicContact CE1-CG2 4.48Å; F368-I393 HydrophobicContact CB-CG1 4.41Å; F368-I393 HydrophobicContact CD1-CG1 4.09Å; F368-I393 VanDerWaalsContact O-CG2 3.27Å; F368-I393 WeakPolarHBondContact O-CG2 3.32Å; F368-I396 HydrophobicContact CD1-CD1 3.47Å; F368-I396 VanDerWaalsContact CD1-CD1 3.47Å; F368-I396 HydrophobicContact CD2-CD1 4.01Å; F368-I396 HydrophobicContact CE1-CD1 3.43Å; F368-I396 VanDerWaalsContact CE1-CD1 3.43Å; F368-I396 HydrophobicContact CE2-CD1 3.99Å; F368-I396 HydrophobicContact CG-CD1 3.76Å; F368-I396 HydrophobicContact CZ-CD1 3.7Å; F368-L564 HydrophobicContact CE2-CD1 3.99Å; F368-L564 HydrophobicContact CZ-CD1 4.35Å; F368-L564 HydrophobicContact CZ-CD2 4.48Å; F368-I670 HydrophobicContact CE1-CD1 4.48Å; F368-I670 HydrophobicContact CZ-CD1 4.03Å; F368-I670 HydrophobicContact CZ-CG1 4.23Å
369	S	86.9	Confident	85.4	Confident	11 Å²	11	51.2 Å²	51.2	8%	0.077	28%	0.283	C	S	.	.			trans	-155.8	150.1	-174.2	60.1	0	0	0	0	112.9	G366 L385	G366-S369 PolarHBondContact N-O 3.03Å; S369-L385 CarbonylContact C-O 3.57Å; S369-L385 WeakPolarHBondContact CA-O 3.31Å; S369-L385 VanDerWaalsContact CB-O 3.31Å; S369-L385 WeakPolarHBondContact CB-O 3.41Å
370	D	88	Confident	85.3	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.027	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	137.6	162.2	-63.9	0.2	0	0	0	108.9	L362 T365 K384 L385 R387 Y425	L362-D370 HydrophobicContact CD1-CB 4.02Å; T365-D370 HydrophobicContact CG2-CB 4.23Å; T365-D370 VanDerWaalsContact CG2-OD1 3.22Å; T365-D370 WeakPolarHBondContact CG2-OD1 3.33Å; D370-K384 CarbonylContact O-C 3.11Å; D370-K384 WeakPolarHBondContact O-CA 3.37Å; D370-L385 HydrophobicContact CB-CB 4.47Å; D370-L385 PolarHBondContact N-O 2.87Å; D370-L385 PolarHBondContact O-N 3.49Å; D370-R387 IonicContact OD1-CZ 3.08Å; D370-R387 IonicContact OD1-NH1 3.73Å; D370-R387 PolarHBondContact OD1-NH1 2.85Å; D370-R387 IonicContact OD1-NH2 2.83Å; D370-R387 PolarHBondContact OD1-NH2 3.22Å; D370-R387 IonicContact OD2-CZ 3.59Å; D370-R387 IonicContact OD2-NH1 2.71Å; D370-R387 PolarHBondContact OD2-NH1 3.47Å; D370-R387 IonicContact OD2-NH2 2.79Å; D370-R387 PolarHBondContact OD2-NH2 2.93Å; D370-Y425 PolarHBondContact OD2-OH 2.89Å
371	V	91.2	Very high	85.5	Confident	29 Å²	29	55.5 Å²	55.5	18%	0.176	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.3	178.7	-170.4	0	0	0	0	109.1	L363 G364 V382 K384	L363-V371 HydrophobicContact CB-CG1 4.41Å; L363-V371 WeakPolarHBondContact CB-O 3.29Å; L363-V371 HydrophobicContact CD1-CG1 4.32Å; L363-V371 PolarHBondContact N-O 3.33Å; G364-V371 PolarHBondContact N-O 2.95Å; G364-V371 PolarHBondContact O-N 2.94Å; V371-V382 HydrophobicContact CG1-CG1 3.64Å; V371-K384 HydrophobicContact CG1-CG 4.28Å; V371-K384 HydrophobicContact CG2-CD 4.38Å; V371-K384 HydrophobicContact CG2-CG 4.21Å
372	W	92.4	Very high	85.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	144.6	-177.3	-71.8	77.6	0	0	0	110.6	L359 N361 L362 V382 A383 Y425 H430 I433 L434	L359-W372 HydrophobicContact CB-CD2 4.23Å; L359-W372 HydrophobicContact CB-CE3 3.81Å; L359-W372 HydrophobicContact CB-CZ3 4.43Å; L359-W372 HydrophobicContact CD1-CD2 4.2Å; L359-W372 HydrophobicContact CD1-CG 4.16Å; L359-W372 HydrophobicContact CD2-CB 4.08Å; N361-W372 VanDerWaalsContact C-CE3 3.42Å; N361-W372 CarbonylContact O-C 3.5Å; N361-W372 VanDerWaalsContact O-CA 3.27Å; N361-W372 WeakPolarHBondContact O-CA 3.37Å; L362-W372 HydrophobicContact CB-CD2 4.25Å; L362-W372 HydrophobicContact CB-CE3 4.28Å; L362-W372 HydrophobicContact CB-CH2 4.05Å; L362-W372 HydrophobicContact CB-CZ2 4.01Å; L362-W372 HydrophobicContact CB-CZ3 4.2Å; L362-W372 HydrophobicContact CD1-CD2 4.19Å; L362-W372 HydrophobicContact CD1-CG 4.37Å; L362-W372 HydrophobicContact CD1-CZ2 3.97Å; L362-W372 HydrophobicContact CG-CZ2 4.46Å; W372-V382 WeakPolarHBondContact O-CA 3.38Å; W372-A383 HydrophobicContact CB-CB 4.25Å; W372-A383 PolarHBondContact N-O 3.41Å; W372-A383 PolarHBondContact O-N 3.3Å; W372-Y425 AromaticContact CE2-CE2 3.98Å; W372-Y425 AromaticContact CZ2-CE2 3.74Å; W372-Y425 HydrophobicContact CZ2-CE2 3.74Å; W372-Y425 AromaticContact CZ2-CZ 3.99Å; W372-Y425 VanDerWaalsContact CZ2-OH 3.32Å; W372-Y425 WeakPolarHBondContact CZ2-OH 3.45Å; W372-Y425 AromaticContact NE1-CE2 3.94Å; W372-Y425 AromaticContact NE1-CZ 3.91Å; W372-Y425 PolarHBondContact NE1-OH 3.1Å; W372-H430 HydrophobicContact CH2-CB 4.14Å; W372-I433 HydrophobicContact CH2-CB 4.28Å; W372-I433 HydrophobicContact CH2-CD1 4.44Å; W372-I433 HydrophobicContact CH2-CG2 3.92Å; W372-I433 HydrophobicContact CZ3-CD1 3.98Å; W372-I433 HydrophobicContact CZ3-CG2 4.05Å; W372-L434 HydrophobicContact CZ2-CD2 4.2Å
373	S	92.5	Very high	86	Confident	23 Å²	23	51.8 Å²	51.8	16%	0.161	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	149.8	155.3	76.5	0	0	0	0	108.5	E360 N361	E360-S373 PolarHBondContact N-O 3.16Å; N361-S373 PolarHBondContact N-O 2.99Å; N361-S373 PolarHBondContact N-OG 3.07Å; N361-S373 PolarHBondContact O-N 2.85Å
374	G	90.9	Very high	86.3	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	-179	171.5	0	0	0	0	0	112	T358 K380 V381	T358-G374 CarbonylContact O-C 3.59Å; T358-G374 WeakPolarHBondContact O-CA 3.37Å; G374-K380 WeakPolarHBondContact O-CA 3.34Å; G374-V381 PolarHBondContact N-O 3.33Å; G374-V381 WeakPolarHBondContact O-CG2 3.39Å; G374-V381 PolarHBondContact O-N 3.5Å
375	T	90.1	Very high	86.6	Confident	32 Å²	32	45.8 Å²	45.8	20%	0.196	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.7	171.7	37.2	0	0	0	0	111.2	I357 T358 E360 E379 K380	I357-T375 WeakPolarHBondContact CA-O 3.24Å; T358-T375 PolarHBondContact N-O 3.36Å; T358-T375 PolarHBondContact O-N 2.9Å; E360-T375 WeakPolarHBondContact OE1-CB 3.46Å; E360-T375 WeakPolarHBondContact OE1-CG2 2.97Å; E360-T375 PolarHBondContact OE1-OG1 2.83Å; T375-E379 CarbonylContact C-O 3.55Å; T375-E379 VanDerWaalsContact CA-O 3.26Å; T375-E379 WeakPolarHBondContact CA-O 3.49Å; T375-K380 HydrophobicContact CG2-CG 4.38Å
376	W	84.8	Confident	87.1	Confident	30 Å²	30	42.4 Å²	42.4	11%	0.114	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	116.6	171.4	-172.1	35.4	0	0	0	108.3	V353 I357 G378 E379 V381 M418 A419	V353-W376 HydrophobicContact CG1-CD2 4.32Å; V353-W376 HydrophobicContact CG1-CZ2 3.85Å; V353-W376 HydrophobicContact CG2-CZ2 3.92Å; I357-W376 HydrophobicContact CD1-CB 4.45Å; I357-W376 HydrophobicContact CD1-CG 4.32Å; I357-W376 HydrophobicContact CG1-CB 3.85Å; I357-W376 HydrophobicContact CG1-CG 3.79Å; W376-G378 PolarHBondContact O-N 3.01Å; W376-E379 PolarHBondContact N-O 2.95Å; W376-E379 PolarHBondContact O-N 3.21Å; W376-V381 HydrophobicContact CB-CG1 3.87Å; W376-V381 HydrophobicContact CB-CG2 4.15Å; W376-M418 HydrophobicContact CE3-CE 4.03Å; W376-M418 HydrophobicContact CZ3-CB 4.35Å; W376-M418 HydrophobicContact CZ3-CE 4.2Å; W376-A419 HydrophobicContact CH2-CB 4.48Å
377	R	82.1	Confident	87.4	Confident	162 Å²	162	42.2 Å²	42.2	61%	0.611	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	27.5	-177.7	-55	-178.9	177.1	-152.5	-3.8	114.4	Q356	Q356-R377 VanDerWaalsContact OE1-NH2 3.08Å
378	G	78.2	Confident	87.4	Confident	68 Å²	68	36.8 Å²	36.8	70%	0.701	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.8	-12.1	-177.1	0	0	0	0	0	115.1	W376	W376-G378 PolarHBondContact O-N 3.01Å
379	E	83.4	Confident	87	Confident	110 Å²	110	39.3 Å²	39.3	51%	0.514	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140.1	173.5	-62	-172.5	155.1	0	0	110.8	T375 W376	T375-E379 CarbonylContact C-O 3.55Å; T375-E379 VanDerWaalsContact CA-O 3.26Å; T375-E379 WeakPolarHBondContact CA-O 3.49Å; W376-E379 PolarHBondContact N-O 2.95Å; W376-E379 PolarHBondContact O-N 3.21Å
380	K	88.9	Confident	86.2	Confident	160 Å²	160	40.9 Å²	40.9	70%	0.696	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.8	132.7	173.4	-70.6	-173.2	175.7	-175.6	0	110.5	G374 T375 A456	G374-K380 WeakPolarHBondContact O-CA 3.34Å; T375-K380 HydrophobicContact CG2-CG 4.38Å; K380-A456 HydrophobicContact CB-CB 3.88Å; K380-A456 VanDerWaalsContact O-CB 3.25Å; K380-A456 WeakPolarHBondContact O-CB 3.2Å
381	V	91.8	Very high	85.6	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	160.3	179.3	-62.9	0	0	0	0	111.2	G374 W376 M418 V453	G374-V381 PolarHBondContact N-O 3.33Å; G374-V381 WeakPolarHBondContact O-CG2 3.39Å; G374-V381 PolarHBondContact O-N 3.5Å; W376-V381 HydrophobicContact CB-CG1 3.87Å; W376-V381 HydrophobicContact CB-CG2 4.15Å; V381-M418 HydrophobicContact CG1-CE 3.94Å; V381-M418 HydrophobicContact CG1-SD 3.8Å; V381-V453 HydrophobicContact CB-CG1 3.9Å; V381-V453 HydrophobicContact CG1-CG1 4.17Å; V381-V453 HydrophobicContact CG2-CG1 4.06Å
382	V	92.9	Very high	85.1	Confident	15 Å²	15	43.6 Å²	43.6	9%	0.091	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123	168.7	173.1	0	0	0	0	108.6	L363 V371 W372 G454 A456	L363-V382 HydrophobicContact CD1-CG2 4.48Å; V371-V382 HydrophobicContact CG1-CG1 3.64Å; W372-V382 WeakPolarHBondContact O-CA 3.38Å; V382-G454 PolarHBondContact N-O 2.98Å; V382-G454 PolarHBondContact O-N 3.3Å; V382-A456 HydrophobicContact CG2-CB 4.3Å
383	A	92.5	Very high	84.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.4	-178.7	0	0	0	0	0	110.3	L359 W372 L451 L452	L359-A383 HydrophobicContact CD2-CB 3.43Å; L359-A383 VanDerWaalsContact CD2-CB 3.43Å; W372-A383 HydrophobicContact CB-CB 4.25Å; W372-A383 PolarHBondContact N-O 3.41Å; W372-A383 PolarHBondContact O-N 3.3Å; A383-L451 HydrophobicContact CB-CD1 3.8Å; A383-L452 CarbonylContact C-O 3.54Å; A383-L452 WeakPolarHBondContact CA-O 3.37Å
384	K	92.4	Very high	84.1	Confident	10 Å²	10	45.3 Å²	45.3	4%	0.043	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.6	174.3	-61	-167.9	-177.4	-179	0	110	D370 V371 F386 L451 L452 Y550 D561	D370-K384 CarbonylContact O-C 3.11Å; D370-K384 WeakPolarHBondContact O-CA 3.37Å; V371-K384 HydrophobicContact CG1-CG 4.28Å; V371-K384 HydrophobicContact CG2-CD 4.38Å; V371-K384 HydrophobicContact CG2-CG 4.21Å; K384-F386 HydrophobicContact CB-CD2 4.38Å; K384-F386 HydrophobicContact CB-CE2 3.6Å; K384-F386 HydrophobicContact CB-CZ 4.25Å; K384-L451 WeakPolarHBondContact O-CA 3.44Å; K384-L452 HydrophobicContact CB-CB 4.41Å; K384-L452 PolarHBondContact N-O 3.06Å; K384-L452 PolarHBondContact O-N 3.37Å; K384-Y550 WeakPolarHBondContact CE-OH 3.18Å; K384-Y550 PolarHBondContact NZ-OH 3.41Å; K384-D561 IonicContact NZ-OD1 2.76Å; K384-D561 PolarHBondContact NZ-OD1 3.4Å; K384-D561 IonicContact NZ-OD2 2.71Å; K384-D561 PolarHBondContact NZ-OD2 3.46Å
385	L	90.5	Very high	83.7	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	115	-179.9	-73.1	173.6	0	0	0	110.7	L359 S369 D370 L423 Y425 C449 L451	L359-L385 HydrophobicContact CD1-CD1 3.75Å; S369-L385 CarbonylContact C-O 3.57Å; S369-L385 WeakPolarHBondContact CA-O 3.31Å; S369-L385 VanDerWaalsContact CB-O 3.31Å; S369-L385 WeakPolarHBondContact CB-O 3.41Å; D370-L385 HydrophobicContact CB-CB 4.47Å; D370-L385 PolarHBondContact N-O 2.87Å; D370-L385 PolarHBondContact O-N 3.49Å; L385-L423 HydrophobicContact CD1-CD2 4.47Å; L385-L423 HydrophobicContact CD2-CB 4.13Å; L385-L423 HydrophobicContact CD2-CD2 4.07Å; L385-Y425 HydrophobicContact CD1-CD1 4.2Å; L385-Y425 HydrophobicContact CD1-CD2 3.47Å; L385-Y425 VanDerWaalsContact CD1-CD2 3.47Å; L385-Y425 HydrophobicContact CD1-CE1 4.26Å; L385-Y425 HydrophobicContact CD1-CE2 3.6Å; L385-Y425 HydrophobicContact CD1-CG 3.78Å; L385-C449 HydrophobicContact CD2-CB 4.2Å; L385-L451 HydrophobicContact CD2-CB 4.19Å; L385-L451 HydrophobicContact CD2-CD1 3.81Å; L385-L451 HydrophobicContact CG-CD1 4.35Å
386	F	88.2	Confident	83.5	Confident	6 Å²	6	45.2 Å²	45.2	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	115.5	179.1	-63.8	-103.8	0	0	0	108.8	F368 K384 I393 I396 W397 A450 L452	F368-F386 HydrophobicContact CB-CE1 4.39Å; F368-F386 WeakPolarHBondContact O-CD1 3.48Å; K384-F386 HydrophobicContact CB-CD2 4.38Å; K384-F386 HydrophobicContact CB-CE2 3.6Å; K384-F386 HydrophobicContact CB-CZ 4.25Å; F386-I393 HydrophobicContact CB-CG2 3.97Å; F386-I393 HydrophobicContact CD1-CG2 3.94Å; F386-I393 HydrophobicContact CG-CG2 4.47Å; F386-I396 HydrophobicContact CE1-CG2 4.18Å; F386-W397 HydrophobicContact CB-CB 4.35Å; F386-W397 HydrophobicContact CD1-CB 4.04Å; F386-W397 HydrophobicContact CD2-CB 4.44Å; F386-W397 AromaticContact CD2-CD1 3.62Å; F386-W397 HydrophobicContact CD2-CG 4.41Å; F386-W397 HydrophobicContact CE1-CB 4.48Å; F386-W397 HydrophobicContact CG-CB 4.03Å; F386-W397 AromaticContact CG-CD1 3.98Å; F386-W397 HydrophobicContact CG-CG 4.37Å; F386-A450 HydrophobicContact CB-CB 4.28Å; F386-A450 PolarHBondContact N-O 2.74Å; F386-A450 PolarHBondContact O-N 2.92Å; F386-L452 HydrophobicContact CD2-CD1 4.48Å; F386-L452 HydrophobicContact CD2-CG 4.33Å; F386-L452 HydrophobicContact CE2-CB 4.24Å; F386-L452 HydrophobicContact CE2-CD1 3.52Å; F386-L452 HydrophobicContact CE2-CG 3.71Å; F386-L452 HydrophobicContact CZ-CD1 3.79Å; F386-L452 HydrophobicContact CZ-CG 4.47Å
387	R	81.7	Confident	83.7	Confident	43 Å²	43	45.1 Å²	45.1	16%	0.162	23%	0.226	C	C	.	.			trans	-76.1	124.8	173.5	-64.8	179.7	-176.3	73.3	2.8	109.1	D370 N389 I393	D370-R387 IonicContact OD1-CZ 3.08Å; D370-R387 IonicContact OD1-NH1 3.73Å; D370-R387 PolarHBondContact OD1-NH1 2.85Å; D370-R387 IonicContact OD1-NH2 2.83Å; D370-R387 PolarHBondContact OD1-NH2 3.22Å; D370-R387 IonicContact OD2-CZ 3.59Å; D370-R387 IonicContact OD2-NH1 2.71Å; D370-R387 PolarHBondContact OD2-NH1 3.47Å; D370-R387 IonicContact OD2-NH2 2.79Å; D370-R387 PolarHBondContact OD2-NH2 2.93Å; R387-N389 PolarHBondContact O-N 3.45Å; R387-I393 WeakPolarHBondContact O-CG2 3.32Å
388	P	75.1	Confident	83.8	Confident	29 Å²	29	40.6 Å²	40.6	19%	0.188	21%	0.212	C	C	.	.	S	Bend	trans	-74.8	34.4	-178.8	33	-37.1	0	0	0	113.8	N390 P448	P388-N390 VanDerWaalsContact C-N 3.28Å; P388-N390 PolarHBondContact O-N 3.42Å; P388-P448 VanDerWaalsContact CD-O 3.31Å; P388-P448 WeakPolarHBondContact CD-O 3.49Å; P388-P448 VanDerWaalsContact CG-O 3.3Å; P388-P448 WeakPolarHBondContact CG-O 3.39Å
389	N	72	Confident	84.2	Confident	89 Å²	89	37.4 Å²	37.4	48%	0.476	18%	0.179	S	C	.	.	S	Bend	trans	-88.6	4.1	-174.3	-55.5	19.6	0	0	0	112.2	R387	R387-N389 PolarHBondContact O-N 3.45Å
390	N	71.9	Confident	84.5	Confident	44 Å²	44	32.5 Å²	32.5	24%	0.235	16%	0.156	C	C	.	.	S	Bend	trans	-155.8	125.3	176.3	-177.4	-13.9	0	0	0	109.1	P388 I392 I393 C394	P388-N390 VanDerWaalsContact C-N 3.28Å; P388-N390 PolarHBondContact O-N 3.42Å; N390-I392 PolarHBondContact O-N 3Å; N390-I392 VanDerWaalsContact O-N 3.14Å; N390-I392 PolarHBondContact OD1-N 3.24Å; N390-I393 HydrophobicContact CB-CB 4.35Å; N390-I393 HydrophobicContact CB-CD1 3.9Å; N390-I393 HydrophobicContact CB-CG1 3.97Å; N390-I393 WeakPolarHBondContact O-CA 3.46Å; N390-I393 WeakPolarHBondContact O-CB 3.25Å; N390-I393 PolarHBondContact O-N 2.92Å; N390-C394 PolarHBondContact O-N 3.36Å; N390-C394 VanDerWaalsContact O-N 3.11Å
391	R	74.7	Confident	84.3	Confident	80 Å²	80	25.3 Å²	25.3	30%	0.302	13%	0.126	S	C	.	.	H	α-helix	trans	-36.5	-46.9	167.1	175.7	-171	173	82.1	47.3	114.4	I393 C394 N395 F654 D655 E658	R391-I393 PolarHBondContact O-N 3.33Å; R391-C394 PolarHBondContact O-N 2.89Å; R391-N395 WeakPolarHBondContact O-CB 3.39Å; R391-N395 PolarHBondContact O-N 3.48Å; R391-N395 PolarHBondContact O-ND2 3.2Å; R391-F654 PolarHBondContact NH2-O 3.17Å; R391-D655 IonicContact CZ-OD1 2.74Å; R391-D655 IonicContact NH1-OD1 2.84Å; R391-D655 PolarHBondContact NH1-OD1 2.92Å; R391-D655 IonicContact NH1-OD2 3.1Å; R391-D655 IonicContact NH2-OD1 2.69Å; R391-D655 PolarHBondContact NH2-OD1 3.22Å; R391-E658 WeakPolarHBondContact CG-OE2 3.47Å; R391-E658 IonicContact CZ-OE2 3.83Å; R391-E658 IonicContact NE-OE1 3.96Å; R391-E658 IonicContact NE-OE2 3.93Å; R391-E658 PolarHBondContact NE-OE2 3.02Å; R391-E658 IonicContact NH2-OE2 2.62Å; R391-E658 PolarHBondContact NH2-OE2 3.29Å
392	I	80.3	Confident	83.8	Confident	12 Å²	12	27.8 Å²	27.8	6%	0.062	14%	0.139	C	C	.	.	H	α-helix	trans	-64.5	-39.5	179.1	-65.8	174.1	0	0	0	111.3	F368 N390 N395 I396 T591 I665	F368-I392 HydrophobicContact CE1-CG2 4.48Å; N390-I392 PolarHBondContact O-N 3Å; N390-I392 VanDerWaalsContact O-N 3.14Å; N390-I392 PolarHBondContact OD1-N 3.24Å; I392-N395 PolarHBondContact O-N 2.95Å; I392-I396 HydrophobicContact CG2-CD1 3.76Å; I392-I396 HydrophobicContact CG2-CG1 4.39Å; I392-I396 WeakPolarHBondContact O-CB 3.48Å; I392-I396 VanDerWaalsContact O-CG1 3.24Å; I392-I396 WeakPolarHBondContact O-CG1 3.2Å; I392-I396 PolarHBondContact O-N 3.45Å; I392-T591 HydrophobicContact CD1-CG2 4.45Å; I392-I665 HydrophobicContact CG2-CG2 3.9Å
393	I	81.5	Confident	83.3	Confident	20 Å²	20	27.1 Å²	27.1	10%	0.103	13%	0.134	C	C	.	.	H	α-helix	trans	-65.1	-45.7	177.3	-64.4	175.5	0	0	0	110.1	F368 F386 R387 N390 R391 N395 I396 W397	F368-I393 HydrophobicContact CB-CG1 4.41Å; F368-I393 HydrophobicContact CD1-CG1 4.09Å; F368-I393 VanDerWaalsContact O-CG2 3.27Å; F368-I393 WeakPolarHBondContact O-CG2 3.32Å; F386-I393 HydrophobicContact CB-CG2 3.97Å; F386-I393 HydrophobicContact CD1-CG2 3.94Å; F386-I393 HydrophobicContact CG-CG2 4.47Å; R387-I393 WeakPolarHBondContact O-CG2 3.32Å; N390-I393 HydrophobicContact CB-CB 4.35Å; N390-I393 HydrophobicContact CB-CD1 3.9Å; N390-I393 HydrophobicContact CB-CG1 3.97Å; N390-I393 WeakPolarHBondContact O-CA 3.46Å; N390-I393 WeakPolarHBondContact O-CB 3.25Å; N390-I393 PolarHBondContact O-N 2.92Å; R391-I393 PolarHBondContact O-N 3.33Å; I393-N395 VanDerWaalsContact C-N 3.31Å; I393-N395 PolarHBondContact O-N 3.28Å; I393-I396 PolarHBondContact O-N 3.4Å; I393-W397 PolarHBondContact O-N 2.72Å
394	C	81.6	Confident	82.7	Confident	39 Å²	39	28.6 Å²	28.6	26%	0.264	14%	0.141	S	C	.	.	H	α-helix	trans	-58.2	-43.3	175.6	-58.5	0	0	0	0	111.6	N390 R391 W397 H398	N390-C394 PolarHBondContact O-N 3.36Å; N390-C394 VanDerWaalsContact O-N 3.11Å; R391-C394 PolarHBondContact O-N 2.89Å; C394-W397 PolarHBondContact O-N 2.86Å; C394-H398 WeakPolarHBondContact O-CB 3.41Å; C394-H398 PolarHBondContact O-N 3.22Å
395	N	83.1	Confident	81.9	Confident	22 Å²	22	36.3 Å²	36.3	12%	0.118	17%	0.17	C	C	.	.	H	α-helix	trans	-74.1	-29.7	-179.5	-73.2	-25.7	0	0	0	113.3	R391 I392 I393 R399 E658 I665	R391-N395 WeakPolarHBondContact O-CB 3.39Å; R391-N395 PolarHBondContact O-N 3.48Å; R391-N395 PolarHBondContact O-ND2 3.2Å; I392-N395 PolarHBondContact O-N 2.95Å; I393-N395 VanDerWaalsContact C-N 3.31Å; I393-N395 PolarHBondContact O-N 3.28Å; N395-R399 VanDerWaalsContact O-CB 3.29Å; N395-R399 WeakPolarHBondContact O-CB 3.34Å; N395-R399 WeakPolarHBondContact O-CG 3.25Å; N395-R399 PolarHBondContact O-N 3.01Å; N395-E658 HydrophobicContact CB-CB 4.49Å; N395-E658 PolarHBondContact ND2-OE2 3.44Å; N395-I665 HydrophobicContact CB-CD1 3.75Å
396	I	86.2	Confident	80.6	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.041	19%	0.194	C	C	.	.	H	α-helix	trans	-66.1	-46.1	169.8	-73.6	167	0	0	0	110.8	F368 F386 I392 I393 T400 L564	F368-I396 HydrophobicContact CD1-CD1 3.47Å; F368-I396 VanDerWaalsContact CD1-CD1 3.47Å; F368-I396 HydrophobicContact CD2-CD1 4.01Å; F368-I396 HydrophobicContact CE1-CD1 3.43Å; F368-I396 VanDerWaalsContact CE1-CD1 3.43Å; F368-I396 HydrophobicContact CE2-CD1 3.99Å; F368-I396 HydrophobicContact CG-CD1 3.76Å; F368-I396 HydrophobicContact CZ-CD1 3.7Å; F386-I396 HydrophobicContact CE1-CG2 4.18Å; I392-I396 HydrophobicContact CG2-CD1 3.76Å; I392-I396 HydrophobicContact CG2-CG1 4.39Å; I392-I396 WeakPolarHBondContact O-CB 3.48Å; I392-I396 VanDerWaalsContact O-CG1 3.24Å; I392-I396 WeakPolarHBondContact O-CG1 3.2Å; I392-I396 PolarHBondContact O-N 3.45Å; I393-I396 PolarHBondContact O-N 3.4Å; I396-T400 WeakPolarHBondContact O-CB 3.11Å; I396-T400 PolarHBondContact O-N 3.44Å; I396-T400 PolarHBondContact O-OG1 3.39Å; I396-L564 HydrophobicContact CD1-CD2 3.71Å; I396-L564 HydrophobicContact CD1-CG 4.42Å; I396-L564 HydrophobicContact CG1-CD2 3.96Å
397	W	88.4	Confident	79.4	Confident	29 Å²	29	39.8 Å²	39.8	11%	0.11	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-53	173	174.7	88	0	0	0	110.4	F386 I393 C394 R399 T400 V401 V420 W422 A450	F386-W397 HydrophobicContact CB-CB 4.35Å; F386-W397 HydrophobicContact CD1-CB 4.04Å; F386-W397 HydrophobicContact CD2-CB 4.44Å; F386-W397 AromaticContact CD2-CD1 3.62Å; F386-W397 HydrophobicContact CD2-CG 4.41Å; F386-W397 HydrophobicContact CE1-CB 4.48Å; F386-W397 HydrophobicContact CG-CB 4.03Å; F386-W397 AromaticContact CG-CD1 3.98Å; F386-W397 HydrophobicContact CG-CG 4.37Å; I393-W397 PolarHBondContact O-N 2.72Å; C394-W397 PolarHBondContact O-N 2.86Å; W397-R399 PolarHBondContact O-N 2.95Å; W397-T400 WeakPolarHBondContact O-CB 3.49Å; W397-T400 PolarHBondContact O-N 3.45Å; W397-T400 VanDerWaalsContact O-N 3.11Å; W397-V401 HydrophobicContact CD2-CG2 4.13Å; W397-V401 HydrophobicContact CH2-CG2 4.49Å; W397-V401 HydrophobicContact CZ2-CG2 4.09Å; W397-V401 WeakPolarHBondContact O-CG2 3.37Å; W397-V401 PolarHBondContact O-N 3.45Å; W397-V420 HydrophobicContact CH2-CG1 4.22Å; W397-V420 HydrophobicContact CZ2-CG1 3.44Å; W397-V420 VanDerWaalsContact CZ2-CG1 3.44Å; W397-W422 AromaticContact CH2-CZ2 3.98Å; W397-W422 HydrophobicContact CH2-CZ2 3.98Å; W397-W422 HydrophobicContact CZ2-CZ2 4.48Å; W397-W422 HydrophobicContact CZ3-CZ2 4.19Å; W397-A450 HydrophobicContact CD2-CB 3.79Å; W397-A450 HydrophobicContact CE3-CB 4.48Å; W397-A450 HydrophobicContact CG-CB 3.9Å; W397-A450 HydrophobicContact CZ2-CB 4.05Å
398	H	85.4	Confident	79	Confident	67 Å²	67	42.7 Å²	42.7	31%	0.31	21%	0.213	S	C	.	.	H	α-helix	trans	-60.4	-42.2	-177.8	-171.7	-105.2	0	0	0	112.4	C394 V401 L402 L659	C394-H398 WeakPolarHBondContact O-CB 3.41Å; C394-H398 PolarHBondContact O-N 3.22Å; H398-V401 PolarHBondContact O-N 2.93Å; H398-L402 VanDerWaalsContact CE1-CD1 3.47Å; H398-L402 WeakPolarHBondContact CE1-CD1 3.39Å; H398-L402 WeakPolarHBondContact O-CB 3.12Å; H398-L402 WeakPolarHBondContact O-CG 3.19Å; H398-L402 PolarHBondContact O-N 3.49Å; H398-L659 WeakPolarHBondContact ND1-CD2 3.31Å
399	R	86.8	Confident	79.3	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-37.8	174.7	-78.6	168.6	70	131.4	-4	113	N395 W397 V401 L402 L403 S565 E658 L660 E661 W663	N395-R399 VanDerWaalsContact O-CB 3.29Å; N395-R399 WeakPolarHBondContact O-CB 3.34Å; N395-R399 WeakPolarHBondContact O-CG 3.25Å; N395-R399 PolarHBondContact O-N 3.01Å; W397-R399 PolarHBondContact O-N 2.95Å; R399-V401 VanDerWaalsContact C-N 3.32Å; R399-V401 PolarHBondContact O-N 2.93Å; R399-L402 PolarHBondContact O-N 2.6Å; R399-L403 VanDerWaalsContact O-CB 3.28Å; R399-L403 WeakPolarHBondContact O-CB 3.47Å; R399-L403 VanDerWaalsContact O-CG 3.23Å; R399-L403 WeakPolarHBondContact O-CG 3.34Å; R399-L403 PolarHBondContact O-N 3.27Å; R399-S565 PolarHBondContact NH2-O 2.74Å; R399-E658 PolarHBondContact NH1-O 3.08Å; R399-E658 VanDerWaalsContact NH1-O 3.08Å; R399-L660 PolarHBondContact NH1-O 3.41Å; R399-E661 PolarHBondContact NH2-O 3.37Å; R399-W663 PolarHBondContact NH1-O 2.97Å; R399-W663 PolarHBondContact NH2-O 3.24Å
400	T	88.6	Confident	79.7	Confident	7 Å²	7	45 Å²	45	4%	0.043	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-46.8	173.6	-52.2	0	0	0	0	110.3	I396 W397 H404 L452 I562 G563	I396-T400 WeakPolarHBondContact O-CB 3.11Å; I396-T400 PolarHBondContact O-N 3.44Å; I396-T400 PolarHBondContact O-OG1 3.39Å; W397-T400 WeakPolarHBondContact O-CB 3.49Å; W397-T400 PolarHBondContact O-N 3.45Å; W397-T400 VanDerWaalsContact O-N 3.11Å; T400-H404 PolarHBondContact O-CD2 2.91Å; T400-H404 VanDerWaalsContact O-CD2 3.24Å; T400-H404 PolarHBondContact O-N 2.99Å; T400-H404 VanDerWaalsContact O-N 3.08Å; T400-L452 HydrophobicContact CG2-CD1 3.6Å; T400-I562 HydrophobicContact CG2-CG1 4.27Å; T400-G563 WeakPolarHBondContact OG1-CA 3.4Å; T400-G563 PolarHBondContact OG1-N 3.43Å
401	V	85.1	Confident	80.4	Confident	8 Å²	8	45.5 Å²	45.5	5%	0.048	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-46.9	176.2	176.3	0	0	0	0	111.8	W397 H398 R399 R405 V420 L452	W397-V401 HydrophobicContact CD2-CG2 4.13Å; W397-V401 HydrophobicContact CH2-CG2 4.49Å; W397-V401 HydrophobicContact CZ2-CG2 4.09Å; W397-V401 WeakPolarHBondContact O-CG2 3.37Å; W397-V401 PolarHBondContact O-N 3.45Å; H398-V401 PolarHBondContact O-N 2.93Å; R399-V401 VanDerWaalsContact C-N 3.32Å; R399-V401 PolarHBondContact O-N 2.93Å; V401-R405 VanDerWaalsContact O-CB 3.31Å; V401-R405 WeakPolarHBondContact O-CB 3.37Å; V401-R405 VanDerWaalsContact O-CG 3.27Å; V401-R405 WeakPolarHBondContact O-CG 3.4Å; V401-R405 PolarHBondContact O-N 3.27Å; V401-R405 VanDerWaalsContact O-N 3.14Å; V401-V420 HydrophobicContact CB-CG1 4.49Å; V401-V420 HydrophobicContact CG1-CG1 4.13Å; V401-V420 HydrophobicContact CG1-CG2 4.26Å; V401-V420 HydrophobicContact CG2-CB 4.34Å; V401-V420 HydrophobicContact CG2-CG1 3.49Å; V401-V420 VanDerWaalsContact CG2-CG1 3.49Å; V401-V420 HydrophobicContact CG2-CG2 3.86Å; V401-L452 HydrophobicContact CG2-CD2 3.56Å
402	L	81.8	Confident	81.1	Confident	53 Å²	53	47 Å²	47	28%	0.277	22%	0.223	S	C	.	.	H	α-helix	trans	-59.5	-55.6	177.5	-76.6	-179.9	0	0	0	110.6	H398 R399 H404 R405 S406	H398-L402 VanDerWaalsContact CE1-CD1 3.47Å; H398-L402 WeakPolarHBondContact CE1-CD1 3.39Å; H398-L402 WeakPolarHBondContact O-CB 3.12Å; H398-L402 WeakPolarHBondContact O-CG 3.19Å; H398-L402 PolarHBondContact O-N 3.49Å; R399-L402 PolarHBondContact O-N 2.6Å; L402-H404 VanDerWaalsContact C-N 3.34Å; L402-H404 PolarHBondContact O-N 3.02Å; L402-R405 CarbonylContact O-C 3.54Å; L402-R405 PolarHBondContact O-N 3.03Å; L402-S406 WeakPolarHBondContact O-CB 3.29Å; L402-S406 PolarHBondContact O-N 3.4Å; L402-S406 PolarHBondContact O-OG 3.41Å
403	L	82.3	Confident	81.7	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-43	-176.8	-71.8	172.6	0	0	0	112.1	R399 R405 V407 L409 L539 I562 E661	R399-L403 VanDerWaalsContact O-CB 3.28Å; R399-L403 WeakPolarHBondContact O-CB 3.47Å; R399-L403 VanDerWaalsContact O-CG 3.23Å; R399-L403 WeakPolarHBondContact O-CG 3.34Å; R399-L403 PolarHBondContact O-N 3.27Å; L403-R405 VanDerWaalsContact C-N 3.3Å; L403-R405 PolarHBondContact O-N 3.36Å; L403-V407 HydrophobicContact CD2-CG2 4.31Å; L403-V407 WeakPolarHBondContact O-CB 3.17Å; L403-V407 PolarHBondContact O-N 3.13Å; L403-L409 HydrophobicContact CB-CD1 3.83Å; L403-L409 WeakPolarHBondContact O-CD1 3.45Å; L403-L539 HydrophobicContact CD2-CD1 4.12Å; L403-L539 HydrophobicContact CD2-CD2 4Å; L403-I562 HydrophobicContact CB-CD1 3.63Å; L403-I562 HydrophobicContact CD1-CB 4.49Å; L403-I562 HydrophobicContact CD1-CD1 4.15Å; L403-I562 HydrophobicContact CD1-CG1 4.29Å; L403-I562 WeakPolarHBondContact CD1-O 3.19Å; L403-E661 HydrophobicContact CD2-CG 4.47Å
404	H	79.6	Confident	82.2	Confident	32 Å²	32	46.5 Å²	46.5	15%	0.148	22%	0.219	C	C	.	.	H	α-helix	trans	-70.9	-19.9	176.2	-79.7	-73.2	0	0	0	114.6	T400 L402 H415 L417 I562	T400-H404 PolarHBondContact O-CD2 2.91Å; T400-H404 VanDerWaalsContact O-CD2 3.24Å; T400-H404 PolarHBondContact O-N 2.99Å; T400-H404 VanDerWaalsContact O-N 3.08Å; L402-H404 VanDerWaalsContact C-N 3.34Å; L402-H404 PolarHBondContact O-N 3.02Å; H404-H415 PolarHBondContact CE1-O 2.89Å; H404-H415 VanDerWaalsContact CE1-O 3.24Å; H404-L417 HydrophobicContact CB-CB 4.08Å; H404-L417 HydrophobicContact CB-CD2 3.49Å; H404-L417 VanDerWaalsContact CB-CD2 3.49Å; H404-L417 HydrophobicContact CB-CG 4.43Å; H404-I562 WeakPolarHBondContact NE2-CD1 3.4Å
405	R	75.4	Confident	82.7	Confident	171 Å²	171	45.4 Å²	45.4	65%	0.645	21%	0.21	S	C	*	.	H	α-helix	trans	-99.2	-40.1	-179.6	-72.9	-179.2	175.3	-179	-1.7	114.1	V401 L402 L403	V401-R405 VanDerWaalsContact O-CB 3.31Å; V401-R405 WeakPolarHBondContact O-CB 3.37Å; V401-R405 VanDerWaalsContact O-CG 3.27Å; V401-R405 WeakPolarHBondContact O-CG 3.4Å; V401-R405 PolarHBondContact O-N 3.27Å; V401-R405 VanDerWaalsContact O-N 3.14Å; L402-R405 CarbonylContact O-C 3.54Å; L402-R405 PolarHBondContact O-N 3.03Å; L403-R405 VanDerWaalsContact C-N 3.3Å; L403-R405 PolarHBondContact O-N 3.36Å
406	S	62.9	Low	82.7	Confident	72 Å²	72	45.3 Å²	45.3	50%	0.503	21%	0.214	S	C	.	.	H	α-helix	trans	-93	-23	-172.9	72.8	0	0	0	0	113.1	L402 E661	L402-S406 WeakPolarHBondContact O-CB 3.29Å; L402-S406 PolarHBondContact O-N 3.4Å; L402-S406 PolarHBondContact O-OG 3.41Å; S406-E661 PolarHBondContact OG-OE1 3.06Å
407	V	63	Low	82.6	Confident	8 Å²	8	46.5 Å²	46.5	5%	0.048	22%	0.221	C	C	.	.	S	Bend	trans	-111.9	142.9	179.7	178.1	0	0	0	0	109.6	L403 L409 K536 P537	L403-V407 HydrophobicContact CD2-CG2 4.31Å; L403-V407 WeakPolarHBondContact O-CB 3.17Å; L403-V407 PolarHBondContact O-N 3.13Å; V407-L409 HydrophobicContact CB-CD1 4.46Å; V407-L409 HydrophobicContact CB-CD2 4.33Å; V407-L409 HydrophobicContact CB-CG 3.92Å; V407-L409 HydrophobicContact CG1-CD1 4.48Å; V407-L409 HydrophobicContact CG1-CD2 3.52Å; V407-L409 HydrophobicContact CG1-CG 3.64Å; V407-L409 PolarHBondContact O-N 2.94Å; V407-K536 HydrophobicContact CG1-CB 4.25Å; V407-K536 HydrophobicContact CG1-CG 3.39Å; V407-P537 HydrophobicContact CG1-CG 4.14Å; V407-P537 HydrophobicContact CG2-CG 3.96Å
408	L	73.2	Confident	82.3	Confident	105 Å²	105	46.9 Å²	46.9	55%	0.55	22%	0.224	S	C	.	.			trans	-69.1	66.7	172.5	-61.7	-179.9	0	0	0	111.4	F525 R534 K536	L408-F525 WeakPolarHBondContact O-CZ 3.36Å; L408-R534 HydrophobicContact CD1-CB 4.38Å; L408-R534 WeakPolarHBondContact CD1-O 3.5Å; L408-R534 WeakPolarHBondContact CG-O 3.21Å; L408-K536 HydrophobicContact CB-CB 4.34Å
409	L	81.1	Confident	81.9	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	22%	0.215	C	C	.	.			trans	-92.4	-4.6	178.8	-63.1	-172.6	0	0	0	114.4	L403 V407 H411 F525 L526 K536 L539 I562	L403-L409 HydrophobicContact CB-CD1 3.83Å; L403-L409 WeakPolarHBondContact O-CD1 3.45Å; V407-L409 HydrophobicContact CB-CD1 4.46Å; V407-L409 HydrophobicContact CB-CD2 4.33Å; V407-L409 HydrophobicContact CB-CG 3.92Å; V407-L409 HydrophobicContact CG1-CD1 4.48Å; V407-L409 HydrophobicContact CG1-CD2 3.52Å; V407-L409 HydrophobicContact CG1-CG 3.64Å; V407-L409 PolarHBondContact O-N 2.94Å; L409-H411 PolarHBondContact O-N 3.32Å; L409-F525 HydrophobicContact CD2-CE1 4.36Å; L409-L526 HydrophobicContact CD2-CD2 4.35Å; L409-K536 HydrophobicContact CD2-CD 4.07Å; L409-K536 HydrophobicContact CD2-CG 4.15Å; L409-L539 HydrophobicContact CD1-CD1 3.83Å; L409-L539 HydrophobicContact CD2-CD1 3.72Å; L409-L539 HydrophobicContact CG-CD1 4.39Å; L409-I562 HydrophobicContact CD1-CD1 3.33Å
410	R	81	Confident	81.8	Confident	164 Å²	164	45.6 Å²	45.6	62%	0.619	22%	0.223	S	C	*	.			trans	-64.4	105.3	173.5	-69.4	-173.7	178.6	-170.3	-4.4	109.5
411	H	86.6	Confident	81.5	Confident	55 Å²	55	46.3 Å²	46.3	26%	0.255	23%	0.226	S	C	.	.			trans	-154.9	141.9	-177.7	179.1	-108.7	0	0	0	109	L409 R413 V414 F525	L409-H411 PolarHBondContact O-N 3.32Å; H411-R413 PolarHBondContact ND1-N 2.57Å; H411-R413 PolarHBondContact O-N 3.47Å; H411-V414 HydrophobicContact CB-CB 4.46Å; H411-V414 HydrophobicContact CB-CG2 4.29Å; H411-V414 PolarHBondContact O-N 2.76Å; H411-F525 HydrophobicContact CB-CD1 3.93Å; H411-F525 HydrophobicContact CB-CD2 4.19Å; H411-F525 HydrophobicContact CB-CE1 3.54Å; H411-F525 HydrophobicContact CB-CE2 3.82Å; H411-F525 HydrophobicContact CB-CG 4.24Å; H411-F525 HydrophobicContact CB-CZ 3.49Å; H411-F525 VanDerWaalsContact CB-CZ 3.49Å; H411-F525 AromaticContact CD2-CD2 3.58Å; H411-F525 AromaticContact CD2-CE2 3.75Å; H411-F525 AromaticContact CE1-CG 3.84Å; H411-F525 AromaticContact CG-CD1 3.9Å; H411-F525 AromaticContact CG-CD2 3.7Å; H411-F525 AromaticContact CG-CE1 4Å; H411-F525 AromaticContact CG-CE2 3.8Å; H411-F525 AromaticContact CG-CG 3.75Å; H411-F525 AromaticContact CG-CZ 3.95Å; H411-F525 AromaticContact ND1-CD1 3.83Å; H411-F525 AromaticContact ND1-CD2 3.99Å; H411-F525 AromaticContact ND1-CG 3.62Å; H411-F525 AromaticContact NE2-CD2 3.84Å
412	Q	88.5	Confident	81.2	Confident	111 Å²	111	49.7 Å²	49.7	52%	0.519	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-21.8	-175.3	-172.1	-179.4	-0.9	0	0	114.1
413	R	94.4	Very high	81.2	Confident	18 Å²	18	47.8 Å²	47.8	7%	0.068	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	12.6	179.2	-45	-53.6	-170.2	-166.9	17.2	113.9	H411 E514 Q521 G522 S556 C557 C558 I559	H411-R413 PolarHBondContact ND1-N 2.57Å; H411-R413 PolarHBondContact O-N 3.47Å; R413-E514 IonicContact CZ-OE1 2.71Å; R413-E514 IonicContact NH2-OE1 2.68Å; R413-E514 PolarHBondContact NH2-OE1 3.47Å; R413-Q521 HydrophobicContact CG-CB 4.17Å; R413-Q521 HydrophobicContact CG-CG 3.99Å; R413-G522 VanDerWaalsContact CB-CA 3.43Å; R413-S556 PolarHBondContact NH1-OG 3.18Å; R413-C557 WeakPolarHBondContact CD-O 3.39Å; R413-C558 VanDerWaalsContact C-CB 3.46Å; R413-C558 WeakPolarHBondContact O-CA 3.44Å; R413-I559 PolarHBondContact O-N 3.18Å
414	V	91.5	Very high	81.1	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.024	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-126.4	134.4	172.3	179.3	0	0	0	0	107.9	H411 G416 F525 L526 I559	H411-V414 HydrophobicContact CB-CB 4.46Å; H411-V414 HydrophobicContact CB-CG2 4.29Å; H411-V414 PolarHBondContact O-N 2.76Å; V414-G416 PolarHBondContact O-N 2.87Å; V414-F525 HydrophobicContact CG2-CD1 3.72Å; V414-F525 HydrophobicContact CG2-CE1 3.91Å; V414-L526 HydrophobicContact CG2-CD2 4Å; V414-L526 HydrophobicContact CG2-CG 4.34Å; V414-I559 CarbonylContact C-O 3.59Å; V414-I559 WeakPolarHBondContact CA-O 3.21Å
415	H	91.9	Very high	81	Confident	17 Å²	17	51.1 Å²	51.1	8%	0.079	25%	0.247	C	C	.	.			trans	-61	128.2	-173.6	-174	-131	0	0	0	111.4	H404 L417 E455 Y550 I559	H404-H415 PolarHBondContact CE1-O 2.89Å; H404-H415 VanDerWaalsContact CE1-O 3.24Å; H415-L417 PolarHBondContact O-N 3.15Å; H415-E455 WeakPolarHBondContact CD2-CG 3.49Å; H415-E455 IonicContact CD2-OE1 3.59Å; H415-E455 WeakPolarHBondContact NE2-CG 3.3Å; H415-E455 PolarHBondContact NE2-O 3.37Å; H415-Y550 HydrophobicContact CB-CD2 4.13Å; H415-Y550 HydrophobicContact CB-CE2 4.35Å; H415-Y550 AromaticContact CD2-CD2 3.92Å; H415-Y550 AromaticContact CG-CD2 3.86Å; H415-Y550 AromaticContact CG-CE2 3.92Å; H415-Y550 AromaticContact ND1-CE2 3.86Å; H415-I559 PolarHBondContact N-O 2.92Å
416	G	82.8	Confident	81	Confident	19 Å²	19	43.3 Å²	43.3	20%	0.196	22%	0.218	C	C	.	.			trans	-75	109.6	-176.1	0	0	0	0	0	113	V414 M418 G454 E455	V414-G416 PolarHBondContact O-N 2.87Å; G416-M418 PolarHBondContact O-N 2.79Å; G416-G454 WeakPolarHBondContact O-CA 3.49Å; G416-E455 PolarHBondContact N-OE1 3.38Å; G416-E455 PolarHBondContact O-N 2.99Å; G416-E455 VanDerWaalsContact O-N 3.1Å
417	L	83.9	Confident	81.6	Confident	34 Å²	34	43 Å²	43	18%	0.178	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	110	165.8	-175.4	70.1	0	0	0	109.9	H404 H415 V420 L452	H404-L417 HydrophobicContact CB-CB 4.08Å; H404-L417 HydrophobicContact CB-CD2 3.49Å; H404-L417 VanDerWaalsContact CB-CD2 3.49Å; H404-L417 HydrophobicContact CB-CG 4.43Å; H415-L417 PolarHBondContact O-N 3.15Å; L417-V420 HydrophobicContact CD1-CG2 4.28Å; L417-V420 HydrophobicContact CD2-CG2 3.68Å; L417-V420 HydrophobicContact CG-CG2 4.19Å; L417-L452 HydrophobicContact CD1-CB 3.95Å; L417-L452 HydrophobicContact CD1-CD2 4.08Å; L417-L452 HydrophobicContact CD1-CG 4.45Å
418	M	81.7	Confident	82.2	Confident	36 Å²	36	50.9 Å²	50.9	18%	0.177	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-44	-178.5	-60	171.6	76.7	0	0	111.9	L117 W376 V381 G416 V453 G454 E455	L117-M418 HydrophobicContact CD1-CE 3.96Å; L117-M418 HydrophobicContact CD2-CG 4.41Å; W376-M418 HydrophobicContact CE3-CE 4.03Å; W376-M418 HydrophobicContact CZ3-CB 4.35Å; W376-M418 HydrophobicContact CZ3-CE 4.2Å; V381-M418 HydrophobicContact CG1-CE 3.94Å; V381-M418 HydrophobicContact CG1-SD 3.8Å; G416-M418 PolarHBondContact O-N 2.79Å; M418-V453 WeakPolarHBondContact CA-O 3.43Å; M418-V453 WeakPolarHBondContact CB-O 3.31Å; M418-V453 PolarHBondContact N-O 2.69Å; M418-G454 VanDerWaalsContact SD-C 3.54Å; M418-E455 HydrophobicContact SD-CB 4.27Å; M418-E455 PolarHBondContact SD-N 3.02Å
419	A	78.5	Confident	82.3	Confident	14 Å²	14	51.6 Å²	51.6	12%	0.116	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.7	-178.4	0	0	0	0	0	113.2	V353 W376 V453	V353-A419 HydrophobicContact CB-CB 4.29Å; V353-A419 HydrophobicContact CG1-CB 3.68Å; V353-A419 HydrophobicContact CG2-CB 4.27Å; W376-A419 HydrophobicContact CH2-CB 4.48Å; A419-V453 HydrophobicContact CB-CB 3.98Å; A419-V453 HydrophobicContact CB-CG2 4.04Å; A419-V453 PolarHBondContact N-O 2.82Å; A419-V453 VanDerWaalsContact N-O 3.1Å; A419-V453 PolarHBondContact O-N 2.96Å
420	V	83	Confident	82.1	Confident	28 Å²	28	51.5 Å²	51.5	17%	0.17	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	128.8	-178.2	178.3	0	0	0	0	107.3	W397 V401 L417 L451 L452	W397-V420 HydrophobicContact CH2-CG1 4.22Å; W397-V420 HydrophobicContact CZ2-CG1 3.44Å; W397-V420 VanDerWaalsContact CZ2-CG1 3.44Å; V401-V420 HydrophobicContact CB-CG1 4.49Å; V401-V420 HydrophobicContact CG1-CG1 4.13Å; V401-V420 HydrophobicContact CG1-CG2 4.26Å; V401-V420 HydrophobicContact CG2-CB 4.34Å; V401-V420 HydrophobicContact CG2-CG1 3.49Å; V401-V420 VanDerWaalsContact CG2-CG1 3.49Å; V401-V420 HydrophobicContact CG2-CG2 3.86Å; L417-V420 HydrophobicContact CD1-CG2 4.28Å; L417-V420 HydrophobicContact CD2-CG2 3.68Å; L417-V420 HydrophobicContact CG-CG2 4.19Å; V420-L451 WeakPolarHBondContact CA-O 3.36Å; V420-L452 HydrophobicContact CB-CD2 4.45Å; V420-L452 HydrophobicContact CG1-CD2 4.12Å; V420-L452 HydrophobicContact CG2-CD2 3.91Å
421	D	82.6	Confident	81.8	Confident	22 Å²	22	46.4 Å²	46.4	12%	0.118	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	-167.2	-176	-145.2	-29.8	0	0	0	112.3	T352 V353 G354 L451	T352-D421 VanDerWaalsContact CB-OD2 3.24Å; T352-D421 WeakPolarHBondContact CB-OD2 3.38Å; V353-D421 WeakPolarHBondContact CA-OD2 3.47Å; V353-D421 WeakPolarHBondContact CB-OD2 3.46Å; V353-D421 PolarHBondContact N-OD2 3.06Å; G354-D421 PolarHBondContact N-OD2 2.77Å; D421-L451 HydrophobicContact CB-CB 4.49Å; D421-L451 HydrophobicContact CB-CD2 4.37Å; D421-L451 PolarHBondContact N-O 2.93Å; D421-L451 PolarHBondContact O-N 2.97Å
422	W	79.6	Confident	81.1	Confident	78 Å²	78	47.1 Å²	47.1	30%	0.295	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	148.2	169	-64.1	82.6	0	0	0	110.9	T323 W397 P448 C449 A450	T323-W422 HydrophobicContact CG2-CZ2 3.8Å; W397-W422 AromaticContact CH2-CZ2 3.98Å; W397-W422 HydrophobicContact CH2-CZ2 3.98Å; W397-W422 HydrophobicContact CZ2-CZ2 4.48Å; W397-W422 HydrophobicContact CZ3-CZ2 4.19Å; W422-P448 HydrophobicContact CE3-CB 4.49Å; W422-C449 WeakPolarHBondContact CA-O 3.43Å; W422-A450 HydrophobicContact CD2-CB 4.23Å; W422-A450 HydrophobicContact CE3-CB 3.87Å; W422-A450 HydrophobicContact CH2-CB 3.78Å; W422-A450 HydrophobicContact CZ2-CB 4.13Å; W422-A450 HydrophobicContact CZ3-CB 3.64Å
423	L	81.1	Confident	80.5	Confident	13 Å²	13	43.1 Å²	43.1	7%	0.068	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	132.2	177.2	-176.1	67.1	0	0	0	110.1	L359 L385 Y425 M427 C449	L359-L423 HydrophobicContact CD1-CD2 3.78Å; L359-L423 HydrophobicContact CG-CD2 4.49Å; L385-L423 HydrophobicContact CD1-CD2 4.47Å; L385-L423 HydrophobicContact CD2-CB 4.13Å; L385-L423 HydrophobicContact CD2-CD2 4.07Å; L423-Y425 PolarHBondContact O-N 3.18Å; L423-M427 HydrophobicContact CD1-CE 4.16Å; L423-M427 HydrophobicContact CD1-SD 4.06Å; L423-M427 HydrophobicContact CD2-CE 4.47Å; L423-C449 PolarHBondContact N-O 3.18Å; L423-C449 PolarHBondContact O-N 2.87Å
424	N	81	Confident	79.5	Confident	103 Å²	103	42.3 Å²	42.3	55%	0.551	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	120.1	169.4	-71.8	-8.1	0	0	0	108.9	M427 S447	N424-M427 WeakPolarHBondContact O-CG 3.25Å; N424-S447 WeakPolarHBondContact CA-O 3.32Å
425	Y	77.4	Confident	78.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	138	-170.8	174.3	-97	0	0	0	111.5	D370 W372 L385 L423 L443 S446 S447	D370-Y425 PolarHBondContact OD2-OH 2.89Å; W372-Y425 AromaticContact CE2-CE2 3.98Å; W372-Y425 AromaticContact CZ2-CE2 3.74Å; W372-Y425 HydrophobicContact CZ2-CE2 3.74Å; W372-Y425 AromaticContact CZ2-CZ 3.99Å; W372-Y425 VanDerWaalsContact CZ2-OH 3.32Å; W372-Y425 WeakPolarHBondContact CZ2-OH 3.45Å; W372-Y425 AromaticContact NE1-CE2 3.94Å; W372-Y425 AromaticContact NE1-CZ 3.91Å; W372-Y425 PolarHBondContact NE1-OH 3.1Å; L385-Y425 HydrophobicContact CD1-CD1 4.2Å; L385-Y425 HydrophobicContact CD1-CD2 3.47Å; L385-Y425 VanDerWaalsContact CD1-CD2 3.47Å; L385-Y425 HydrophobicContact CD1-CE1 4.26Å; L385-Y425 HydrophobicContact CD1-CE2 3.6Å; L385-Y425 HydrophobicContact CD1-CG 3.78Å; L423-Y425 PolarHBondContact O-N 3.18Å; Y425-L443 HydrophobicContact CD1-CD1 3.62Å; Y425-L443 HydrophobicContact CE1-CD1 3.5Å; Y425-S446 PolarHBondContact N-OG 3.48Å; Y425-S447 PolarHBondContact N-O 2.77Å; Y425-S447 PolarHBondContact O-N 3.29Å; Y425-S447 PolarHBondContact O-OG 3.2Å
426	P	75.6	Confident	77.7	Confident	7 Å²	7	58.3 Å²	58.3	5%	0.045	29%	0.286	C	S	.	.	S	Bend	cis	-71.2	149.8	0.5	32.2	-36.5	0	0	0	111.9	L431 L434 L443 S446	P426-L431 HydrophobicContact CB-CD2 3.81Å; P426-L431 HydrophobicContact CG-CD2 3.64Å; P426-L434 HydrophobicContact CB-CD1 3.72Å; P426-L443 HydrophobicContact CG-CB 3.95Å; P426-S446 WeakPolarHBondContact O-CB 3.39Å; P426-S446 PolarHBondContact O-OG 3.32Å
427	M	76.2	Confident	76.9	Confident	66 Å²	66	63.7 Å²	63.7	33%	0.325	30%	0.301	S	S	.	.			trans	-86.9	151.4	162	-63.7	-159.7	-70.5	0	0	108.2	L423 N424 M429 H430 L431	L423-M427 HydrophobicContact CD1-CE 4.16Å; L423-M427 HydrophobicContact CD1-SD 4.06Å; L423-M427 HydrophobicContact CD2-CE 4.47Å; N424-M427 WeakPolarHBondContact O-CG 3.25Å; M427-M429 VanDerWaalsContact C-N 3.26Å; M427-M429 PolarHBondContact O-N 3.44Å; M427-H430 WeakPolarHBondContact CE-CE1 3.26Å; M427-H430 WeakPolarHBondContact O-CB 3.49Å; M427-H430 PolarHBondContact O-N 3.32Å; M427-L431 PolarHBondContact O-N 2.73Å
428	E	75	Confident	76	Confident	174 Å²	174	64.6 Å²	64.6	81%	0.813	30%	0.304	S	S	*	.	H	α-helix	trans	-52.6	-43.7	-176.3	-173.5	174.7	-169.6	0	0	112.6	H430 L431	E428-H430 PolarHBondContact O-N 3.07Å; E428-H430 VanDerWaalsContact O-N 3.11Å; E428-L431 HydrophobicContact CG-CD1 4.49Å; E428-L431 WeakPolarHBondContact O-CB 3.46Å; E428-L431 PolarHBondContact O-N 2.87Å; E428-L431 VanDerWaalsContact O-N 3.08Å
429	M	74.5	Confident	74.9	Confident	119 Å²	119	69.4 Å²	69.4	59%	0.586	34%	0.34	S	S	*	.	H	α-helix	trans	-56.4	-27.1	176.1	-167.9	177.3	75.8	0	0	113.9	T358 M427 S432	T358-M429 HydrophobicContact CG2-CE 4.3Å; M427-M429 VanDerWaalsContact C-N 3.26Å; M427-M429 PolarHBondContact O-N 3.44Å; M429-S432 PolarHBondContact O-OG 3.33Å
430	H	76.4	Confident	73.9	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-91.1	-12.4	-178.2	-51.7	163.4	0	0	0	113.1	W372 M427 E428 S432 I433 L434	W372-H430 HydrophobicContact CH2-CB 4.14Å; M427-H430 WeakPolarHBondContact CE-CE1 3.26Å; M427-H430 WeakPolarHBondContact O-CB 3.49Å; M427-H430 PolarHBondContact O-N 3.32Å; E428-H430 PolarHBondContact O-N 3.07Å; E428-H430 VanDerWaalsContact O-N 3.11Å; H430-S432 VanDerWaalsContact C-N 3.26Å; H430-S432 PolarHBondContact O-N 2.94Å; H430-I433 PolarHBondContact O-N 3.01Å; H430-I433 VanDerWaalsContact O-N 3.16Å; H430-L434 WeakPolarHBondContact O-CG 3.49Å; H430-L434 PolarHBondContact O-N 2.94Å
431	L	75	Confident	72.7	Confident	57 Å²	57	77.3 Å²	77.3	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-34.4	-179	-66.3	174.8	0	0	0	112.1	P426 M427 E428 L434 K435	P426-L431 HydrophobicContact CB-CD2 3.81Å; P426-L431 HydrophobicContact CG-CD2 3.64Å; M427-L431 PolarHBondContact O-N 2.73Å; E428-L431 HydrophobicContact CG-CD1 4.49Å; E428-L431 WeakPolarHBondContact O-CB 3.46Å; E428-L431 PolarHBondContact O-N 2.87Å; E428-L431 VanDerWaalsContact O-N 3.08Å; L431-L434 PolarHBondContact O-N 2.77Å; L431-K435 WeakPolarHBondContact O-CB 3.07Å; L431-K435 VanDerWaalsContact O-CG 3.28Å; L431-K435 WeakPolarHBondContact O-CG 3.36Å; L431-K435 PolarHBondContact O-N 2.95Å
432	S	73.4	Confident	71.4	Confident	69 Å²	69	79.9 Å²	79.9	48%	0.483	39%	0.394	S	S	.	.	H	α-helix	trans	-64.5	-38.2	175.7	60.1	0	0	0	0	112.4	M429 H430	M429-S432 PolarHBondContact O-OG 3.33Å; H430-S432 VanDerWaalsContact C-N 3.26Å; H430-S432 PolarHBondContact O-N 2.94Å
433	I	75.4	Confident	70.4	Confident	27 Å²	27	77.2 Å²	77.2	14%	0.138	39%	0.386	C	S	.	.	H	α-helix	trans	-70.1	-49.9	176.1	-58.9	170.9	0	0	0	109.1	E360 L362 W372 H430 K435 R436 Y437	E360-I433 WeakPolarHBondContact O-CD1 3.43Å; L362-I433 HydrophobicContact CB-CG2 4.43Å; W372-I433 HydrophobicContact CH2-CB 4.28Å; W372-I433 HydrophobicContact CH2-CD1 4.44Å; W372-I433 HydrophobicContact CH2-CG2 3.92Å; W372-I433 HydrophobicContact CZ3-CD1 3.98Å; W372-I433 HydrophobicContact CZ3-CG2 4.05Å; H430-I433 PolarHBondContact O-N 3.01Å; H430-I433 VanDerWaalsContact O-N 3.16Å; I433-K435 VanDerWaalsContact C-N 3.32Å; I433-K435 PolarHBondContact O-N 3.26Å; I433-R436 WeakPolarHBondContact O-CB 3.42Å; I433-R436 PolarHBondContact O-N 2.92Å; I433-Y437 HydrophobicContact CG2-CD2 4.01Å; I433-Y437 HydrophobicContact CG2-CE2 3.79Å; I433-Y437 WeakPolarHBondContact O-CD2 3.27Å; I433-Y437 PolarHBondContact O-N 2.66Å
434	L	74.2	Confident	69.4	Low	2 Å²	2	82.8 Å²	82.8	1%	0.01	42%	0.421	C	S	.	.	H	α-helix	trans	-59.1	-40	-179	-72.8	170.2	0	0	0	112.8	L362 W372 P426 H430 L431 R436 Y437 F438 P441	L362-L434 HydrophobicContact CD2-CD2 4.39Å; W372-L434 HydrophobicContact CZ2-CD2 4.2Å; P426-L434 HydrophobicContact CB-CD1 3.72Å; H430-L434 WeakPolarHBondContact O-CG 3.49Å; H430-L434 PolarHBondContact O-N 2.94Å; L431-L434 PolarHBondContact O-N 2.77Å; L434-R436 PolarHBondContact O-N 2.94Å; L434-Y437 PolarHBondContact O-N 3.5Å; L434-Y437 VanDerWaalsContact O-N 3.1Å; L434-F438 HydrophobicContact CD2-CD2 4.04Å; L434-F438 HydrophobicContact CD2-CE2 3.76Å; L434-F438 WeakPolarHBondContact O-CD2 3.33Å; L434-F438 PolarHBondContact O-N 2.9Å; L434-P441 HydrophobicContact CB-CB 4.49Å
435	K	72.7	Confident	68.8	Low	147 Å²	147	83 Å²	83	64%	0.639	43%	0.425	S	S	*	.	H	α-helix	trans	-62.8	-15.8	174.4	-75.2	176	178.9	-174.5	0	114.6	L431 I433 P441	L431-K435 WeakPolarHBondContact O-CB 3.07Å; L431-K435 VanDerWaalsContact O-CG 3.28Å; L431-K435 WeakPolarHBondContact O-CG 3.36Å; L431-K435 PolarHBondContact O-N 2.95Å; I433-K435 VanDerWaalsContact C-N 3.32Å; I433-K435 PolarHBondContact O-N 3.26Å; K435-P441 HydrophobicContact CG-CG 4.37Å
436	R	72	Confident	68.7	Low	210 Å²	210	86 Å²	86	79%	0.792	45%	0.447	S	S	*	.	H	α-helix	trans	-85.8	-28.8	173	-64.6	174.4	-178.3	173.9	0.1	112.9	I433 L434	I433-R436 WeakPolarHBondContact O-CB 3.42Å; I433-R436 PolarHBondContact O-N 2.92Å; L434-R436 PolarHBondContact O-N 2.94Å
437	Y	64.8	Low	68.7	Low	132 Å²	132	87.2 Å²	87.2	52%	0.518	46%	0.455	S	S	.	.	H	α-helix	trans	-94.9	-21.4	-177.5	-73.3	-79.4	0	0	0	113.5	L362 I433 L434	L362-Y437 HydrophobicContact CB-CD2 4.16Å; L362-Y437 HydrophobicContact CB-CE2 3.97Å; L362-Y437 HydrophobicContact CD2-CD1 4.44Å; L362-Y437 HydrophobicContact CD2-CD2 3.92Å; L362-Y437 HydrophobicContact CD2-CG 3.89Å; L362-Y437 PolarHBondContact O-OH 3.47Å; I433-Y437 HydrophobicContact CG2-CD2 4.01Å; I433-Y437 HydrophobicContact CG2-CE2 3.79Å; I433-Y437 WeakPolarHBondContact O-CD2 3.27Å; I433-Y437 PolarHBondContact O-N 2.66Å; L434-Y437 PolarHBondContact O-N 3.5Å; L434-Y437 VanDerWaalsContact O-N 3.1Å
438	F	66.7	Low	68.9	Low	53 Å²	53	87.5 Å²	87.5	23%	0.232	46%	0.462	C	S	.	.			trans	-129.9	126.1	-177.7	-59.2	-80.1	0	0	0	110.8	L362 T365 L434 E440 P442	L362-F438 HydrophobicContact CD2-CE2 4.05Å; T365-F438 HydrophobicContact CG2-CZ 3.77Å; L434-F438 HydrophobicContact CD2-CD2 4.04Å; L434-F438 HydrophobicContact CD2-CE2 3.76Å; L434-F438 WeakPolarHBondContact O-CD2 3.33Å; L434-F438 PolarHBondContact O-N 2.9Å; F438-E440 WeakPolarHBondContact CB-O 3.36Å; F438-E440 PolarHBondContact O-N 3.28Å; F438-P442 HydrophobicContact CD1-CG 4.36Å; F438-P442 HydrophobicContact CD2-CG 4.44Å; F438-P442 HydrophobicContact CE1-CG 4.35Å; F438-P442 HydrophobicContact CE2-CG 4.43Å; F438-P442 HydrophobicContact CG-CG 4.42Å; F438-P442 HydrophobicContact CZ-CG 4.39Å
439	S	57.5	Low	69.3	Low	136 Å²	136	79.2 Å²	79.2	95%	0.951	42%	0.423	S	S	*	.	S	Bend	trans	-57.6	-37.7	174.5	-47.1	0	0	0	0	112
440	E	58.4	Low	69.8	Low	172 Å²	172	73.8 Å²	73.8	80%	0.804	40%	0.397	S	S	*	.	S	Bend	trans	-123.4	119.6	162.4	-64.6	-167.4	158.2	0	0	108.3	F438	F438-E440 WeakPolarHBondContact CB-O 3.36Å; F438-E440 PolarHBondContact O-N 3.28Å
441	P	57.5	Low	70.4	Confident	36 Å²	36	73.8 Å²	73.8	23%	0.234	40%	0.397	C	S	.	.			trans	-64	126.5	179.7	25.9	-32.9	0	0	0	109.5	L434 K435 L443	L434-P441 HydrophobicContact CB-CB 4.49Å; K435-P441 HydrophobicContact CG-CG 4.37Å; P441-L443 PolarHBondContact O-N 2.97Å
442	P	55.9	Low	71	Confident	77 Å²	77	71.5 Å²	71.5	50%	0.5	39%	0.385	S	S	.	.	S	Bend	trans	-69.2	5.5	-173.9	28.4	-36.9	0	0	0	114.2	F438	F438-P442 HydrophobicContact CD1-CG 4.36Å; F438-P442 HydrophobicContact CD2-CG 4.44Å; F438-P442 HydrophobicContact CE1-CG 4.35Å; F438-P442 HydrophobicContact CE2-CG 4.43Å; F438-P442 HydrophobicContact CG-CG 4.42Å; F438-P442 HydrophobicContact CZ-CG 4.39Å
443	L	58.5	Low	71.7	Confident	22 Å²	22	68.2 Å²	68.2	12%	0.115	36%	0.362	C	S	.	.			trans	-144.7	110.5	-178.4	-61.8	171.3	0	0	0	109.6	Y425 P426 P441	Y425-L443 HydrophobicContact CD1-CD1 3.62Å; Y425-L443 HydrophobicContact CE1-CD1 3.5Å; P426-L443 HydrophobicContact CG-CB 3.95Å; P441-L443 PolarHBondContact O-N 2.97Å
444	T	59.8	Low	72.3	Confident	130 Å²	130	67.2 Å²	67.2	80%	0.798	36%	0.358	S	S	*	.	S	Bend	trans	-94.9	-20	165.4	50.3	0	0	0	0	112.4
445	V	68.2	Low	72.9	Confident	107 Å²	107	68.3 Å²	68.3	65%	0.648	36%	0.364	S	S	*	.	S	Bend	trans	-112.8	132	-176.5	-176.7	0	0	0	0	110.2
446	S	75.9	Confident	73.7	Confident	64 Å²	64	63.5 Å²	63.5	45%	0.448	35%	0.351	S	S	.	.			trans	-72.1	129.5	175.1	-157.3	0	0	0	0	110.8	Y425 P426	Y425-S446 PolarHBondContact N-OG 3.48Å; P426-S446 WeakPolarHBondContact O-CB 3.39Å; P426-S446 PolarHBondContact O-OG 3.32Å
447	S	74.5	Confident	74.5	Confident	32 Å²	32	54.3 Å²	54.3	22%	0.224	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	148.9	-176.4	63.2	0	0	0	0	111.3	N424 Y425 C449	N424-S447 WeakPolarHBondContact CA-O 3.32Å; Y425-S447 PolarHBondContact N-O 2.77Å; Y425-S447 PolarHBondContact O-N 3.29Å; Y425-S447 PolarHBondContact O-OG 3.2Å; S447-C449 PolarHBondContact O-N 3.46Å; S447-C449 VanDerWaalsContact O-N 3.1Å
448	P	80.2	Confident	75.4	Confident	72 Å²	72	51.2 Å²	51.2	47%	0.468	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	111.3	178.2	27.2	-33.9	0	0	0	110.4	P388 W422	P388-P448 VanDerWaalsContact CD-O 3.31Å; P388-P448 WeakPolarHBondContact CD-O 3.49Å; P388-P448 VanDerWaalsContact CG-O 3.3Å; P388-P448 WeakPolarHBondContact CG-O 3.39Å; W422-P448 HydrophobicContact CE3-CB 4.49Å
449	C	83.2	Confident	76.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	141.5	174.4	-67.5	0	0	0	0	110	L385 W422 L423 S447	L385-C449 HydrophobicContact CD2-CB 4.2Å; W422-C449 WeakPolarHBondContact CA-O 3.43Å; L423-C449 PolarHBondContact N-O 3.18Å; L423-C449 PolarHBondContact O-N 2.87Å; S447-C449 PolarHBondContact O-N 3.46Å; S447-C449 VanDerWaalsContact O-N 3.1Å
450	A	85.6	Confident	77.9	Confident	4 Å²	4	47.1 Å²	47.1	3%	0.033	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.4	176.9	0	0	0	0	0	109.6	F386 W397 W422	F386-A450 HydrophobicContact CB-CB 4.28Å; F386-A450 PolarHBondContact N-O 2.74Å; F386-A450 PolarHBondContact O-N 2.92Å; W397-A450 HydrophobicContact CD2-CB 3.79Å; W397-A450 HydrophobicContact CE3-CB 4.48Å; W397-A450 HydrophobicContact CG-CB 3.9Å; W397-A450 HydrophobicContact CZ2-CB 4.05Å; W422-A450 HydrophobicContact CD2-CB 4.23Å; W422-A450 HydrophobicContact CE3-CB 3.87Å; W422-A450 HydrophobicContact CH2-CB 3.78Å; W422-A450 HydrophobicContact CZ2-CB 4.13Å; W422-A450 HydrophobicContact CZ3-CB 3.64Å
451	L	88.1	Confident	79.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	130.9	-172.7	175.9	63.4	0	0	0	110.4	I357 A383 K384 L385 V420 D421 V453	I357-L451 HydrophobicContact CD1-CD2 4.36Å; A383-L451 HydrophobicContact CB-CD1 3.8Å; K384-L451 WeakPolarHBondContact O-CA 3.44Å; L385-L451 HydrophobicContact CD2-CB 4.19Å; L385-L451 HydrophobicContact CD2-CD1 3.81Å; L385-L451 HydrophobicContact CG-CD1 4.35Å; V420-L451 WeakPolarHBondContact CA-O 3.36Å; D421-L451 HydrophobicContact CB-CB 4.49Å; D421-L451 HydrophobicContact CB-CD2 4.37Å; D421-L451 PolarHBondContact N-O 2.93Å; D421-L451 PolarHBondContact O-N 2.97Å; L451-V453 HydrophobicContact CD1-CG2 4.29Å; L451-V453 HydrophobicContact CD2-CG2 3.96Å; L451-V453 HydrophobicContact CG-CG2 3.86Å
452	L	89.5	Confident	81.1	Confident	9 Å²	9	38.1 Å²	38.1	5%	0.047	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.8	161	-59.1	-178.8	0	0	0	109.1	A383 K384 F386 T400 V401 L417 V420	A383-L452 CarbonylContact C-O 3.54Å; A383-L452 WeakPolarHBondContact CA-O 3.37Å; K384-L452 HydrophobicContact CB-CB 4.41Å; K384-L452 PolarHBondContact N-O 3.06Å; K384-L452 PolarHBondContact O-N 3.37Å; F386-L452 HydrophobicContact CD2-CD1 4.48Å; F386-L452 HydrophobicContact CD2-CG 4.33Å; F386-L452 HydrophobicContact CE2-CB 4.24Å; F386-L452 HydrophobicContact CE2-CD1 3.52Å; F386-L452 HydrophobicContact CE2-CG 3.71Å; F386-L452 HydrophobicContact CZ-CD1 3.79Å; F386-L452 HydrophobicContact CZ-CG 4.47Å; T400-L452 HydrophobicContact CG2-CD1 3.6Å; V401-L452 HydrophobicContact CG2-CD2 3.56Å; L417-L452 HydrophobicContact CD1-CB 3.95Å; L417-L452 HydrophobicContact CD1-CD2 4.08Å; L417-L452 HydrophobicContact CD1-CG 4.45Å; V420-L452 HydrophobicContact CB-CD2 4.45Å; V420-L452 HydrophobicContact CG1-CD2 4.12Å; V420-L452 HydrophobicContact CG2-CD2 3.91Å
453	V	88.1	Confident	82.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	118.1	-179.9	-169.9	0	0	0	0	107.6	V353 I357 V381 M418 A419 L451	V353-V453 HydrophobicContact CG1-CG2 4.47Å; I357-V453 HydrophobicContact CD1-CB 4.1Å; I357-V453 HydrophobicContact CD1-CG1 3.64Å; I357-V453 HydrophobicContact CD1-CG2 3.3Å; V381-V453 HydrophobicContact CB-CG1 3.9Å; V381-V453 HydrophobicContact CG1-CG1 4.17Å; V381-V453 HydrophobicContact CG2-CG1 4.06Å; M418-V453 WeakPolarHBondContact CA-O 3.43Å; M418-V453 WeakPolarHBondContact CB-O 3.31Å; M418-V453 PolarHBondContact N-O 2.69Å; A419-V453 HydrophobicContact CB-CB 3.98Å; A419-V453 HydrophobicContact CB-CG2 4.04Å; A419-V453 PolarHBondContact N-O 2.82Å; A419-V453 VanDerWaalsContact N-O 3.1Å; A419-V453 PolarHBondContact O-N 2.96Å; L451-V453 HydrophobicContact CD1-CG2 4.29Å; L451-V453 HydrophobicContact CD2-CG2 3.96Å; L451-V453 HydrophobicContact CG-CG2 3.86Å
454	G	87.5	Confident	83.9	Confident	6 Å²	6	41.1 Å²	41.1	6%	0.062	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	166.1	177.4	0	0	0	0	0	112.5	V382 G416 M418	V382-G454 PolarHBondContact N-O 2.98Å; V382-G454 PolarHBondContact O-N 3.3Å; G416-G454 WeakPolarHBondContact O-CA 3.49Å; M418-G454 VanDerWaalsContact SD-C 3.54Å
455	E	87	Confident	85.2	Confident	26 Å²	26	35 Å²	35	12%	0.121	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	137.8	176	59.6	-173.8	174.1	0	0	112	H415 G416 M418 C457 R552	H415-E455 WeakPolarHBondContact CD2-CG 3.49Å; H415-E455 IonicContact CD2-OE1 3.59Å; H415-E455 WeakPolarHBondContact NE2-CG 3.3Å; H415-E455 PolarHBondContact NE2-O 3.37Å; G416-E455 PolarHBondContact N-OE1 3.38Å; G416-E455 PolarHBondContact O-N 2.99Å; G416-E455 VanDerWaalsContact O-N 3.1Å; M418-E455 HydrophobicContact SD-CB 4.27Å; M418-E455 PolarHBondContact SD-N 3.02Å; E455-C457 PolarHBondContact O-N 3.45Å; E455-R552 VanDerWaalsContact CD-NH1 3.3Å; E455-R552 IonicContact OE1-CZ 3.91Å; E455-R552 IonicContact OE1-NH1 3.3Å; E455-R552 PolarHBondContact OE1-NH1 2.69Å; E455-R552 IonicContact OE1-NH2 3.87Å; E455-R552 IonicContact OE2-CZ 2.81Å; E455-R552 IonicContact OE2-NH1 3.51Å; E455-R552 PolarHBondContact OE2-NH1 3.17Å; E455-R552 IonicContact OE2-NH2 3.97Å; E455-R552 PolarHBondContact OE2-NH2 2.95Å
456	A	89.2	Confident	85.9	Confident	45 Å²	45	30 Å²	30	37%	0.372	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-79.4	119	169.8	0	0	0	0	0	110.3	K380 V382	K380-A456 HydrophobicContact CB-CB 3.88Å; K380-A456 VanDerWaalsContact O-CB 3.25Å; K380-A456 WeakPolarHBondContact O-CB 3.2Å; V382-A456 HydrophobicContact CG2-CB 4.3Å
457	C	89.4	Confident	85.9	Confident	17 Å²	17	28.9 Å²	28.9	12%	0.115	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-88.5	136.6	174.2	-69.6	0	0	0	0	110.3	E455 Y459 G460 Y550 V551	E455-C457 PolarHBondContact O-N 3.45Å; C457-Y459 VanDerWaalsContact C-N 3.29Å; C457-Y459 PolarHBondContact O-N 3.46Å; C457-G460 PolarHBondContact O-N 3.21Å; C457-G460 VanDerWaalsContact O-N 3.07Å; C457-Y550 VanDerWaalsContact SG-CB 3.57Å; C457-V551 WeakPolarHBondContact CB-O 3.37Å
458	A	82.5	Confident	85.5	Confident	68 Å²	68	31.8 Å²	31.8	56%	0.562	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-33.8	-165.3	0	0	0	0	0	114.6	V551	A458-V551 PolarHBondContact N-O 3.18Å
459	Y	86.3	Confident	84.1	Confident	75 Å²	75	30.4 Å²	30.4	29%	0.294	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	18.6	179.5	-58.1	-80.2	0	0	0	113	C457 F465 W471 V551 R552 W555	C457-Y459 VanDerWaalsContact C-N 3.29Å; C457-Y459 PolarHBondContact O-N 3.46Å; Y459-F465 HydrophobicContact CD2-CE2 4.3Å; Y459-F465 HydrophobicContact CG-CD2 4.07Å; Y459-F465 HydrophobicContact CG-CE2 4.17Å; Y459-W471 HydrophobicContact CD1-CH2 4.14Å; Y459-W471 HydrophobicContact CE1-CH2 4.27Å; Y459-W471 HydrophobicContact CE1-CZ3 4.27Å; Y459-V551 HydrophobicContact CD2-CG1 4.18Å; Y459-V551 PolarHBondContact N-O 3.46Å; Y459-R552 WeakPolarHBondContact CD2-O 3.44Å; Y459-W555 AromaticContact CE2-CD1 3.57Å; Y459-W555 AromaticContact CE2-NE1 3.84Å; Y459-W555 AromaticContact CZ-CD1 3.96Å; Y459-W555 AromaticContact CZ-NE1 3.78Å; Y459-W555 PolarHBondContact OH-NE1 3Å; Y459-W555 VanDerWaalsContact OH-NE1 3.16Å
460	G	89.8	Confident	82.5	Confident	27 Å²	27	34.2 Å²	34.2	28%	0.278	21%	0.212	S	C	.	.			trans	68.1	-140.7	180	0	0	0	0	0	113.4	C457 Y550 V551	C457-G460 PolarHBondContact O-N 3.21Å; C457-G460 VanDerWaalsContact O-N 3.07Å; G460-Y550 WeakPolarHBondContact O-CA 3.04Å; G460-V551 PolarHBondContact O-N 3.05Å
461	T	91.4	Very high	81	Confident	19 Å²	19	35 Å²	35	12%	0.117	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-83.9	160.7	175	74.6	0	0	0	0	111.3	K463 D464 F465 S547 I549 Y550	T461-K463 PolarHBondContact O-N 3.23Å; T461-K463 WeakPolarHBondContact OG1-CB 3.3Å; T461-K463 PolarHBondContact OG1-N 3.14Å; T461-D464 VanDerWaalsContact CB-OD2 3.29Å; T461-D464 WeakPolarHBondContact CB-OD2 3.45Å; T461-D464 WeakPolarHBondContact CG2-OD2 3.23Å; T461-D464 PolarHBondContact N-OD2 2.98Å; T461-D464 PolarHBondContact O-N 3.35Å; T461-D464 VanDerWaalsContact O-N 3.1Å; T461-D464 PolarHBondContact OG1-N 3.01Å; T461-D464 PolarHBondContact OG1-OD1 3.03Å; T461-D464 PolarHBondContact OG1-OD2 2.78Å; T461-F465 WeakPolarHBondContact O-CB 3.44Å; T461-F465 PolarHBondContact O-N 3Å; T461-S547 VanDerWaalsContact CG2-O 3.27Å; T461-S547 WeakPolarHBondContact CG2-O 3.39Å; T461-I549 CarbonylContact C-O 3.55Å; T461-I549 WeakPolarHBondContact CA-O 3.29Å; T461-I549 WeakPolarHBondContact CB-O 3.48Å; T461-Y550 HydrophobicContact CG2-CD1 4.01Å; T461-Y550 HydrophobicContact CG2-CE1 3.68Å
462	L	92.9	Very high	78.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-28	172.8	-177.9	64.2	0	0	0	111.4	F465 L466 I515 P546 I549 V551 I704 V708	L462-F465 HydrophobicContact CD1-CB 4.46Å; L462-F465 HydrophobicContact CD1-CD1 4.29Å; L462-F465 HydrophobicContact CD1-CG 4.48Å; L462-L466 HydrophobicContact CD1-CD1 4.03Å; L462-L466 HydrophobicContact CD1-CD2 4.33Å; L462-L466 HydrophobicContact CD1-CG 3.92Å; L462-L466 HydrophobicContact CD2-CD1 4.47Å; L462-L466 HydrophobicContact CG-CD1 3.84Å; L462-L466 HydrophobicContact CG-CG 4.18Å; L462-L466 WeakPolarHBondContact O-CB 3.24Å; L462-L466 WeakPolarHBondContact O-CG 3.15Å; L462-L466 PolarHBondContact O-N 3.37Å; L462-I515 HydrophobicContact CD1-CD1 4.03Å; L462-I515 HydrophobicContact CD1-CG2 4.08Å; L462-I515 HydrophobicContact CD2-CG2 4.4Å; L462-P546 HydrophobicContact CB-CB 4.21Å; L462-P546 WeakPolarHBondContact CB-O 3.4Å; L462-P546 HydrophobicContact CD2-CB 4.44Å; L462-P546 HydrophobicContact CG-CB 4.27Å; L462-P546 PolarHBondContact N-O 3.45Å; L462-P546 VanDerWaalsContact N-O 3.14Å; L462-I549 HydrophobicContact CB-CB 4.01Å; L462-I549 HydrophobicContact CB-CG2 3.99Å; L462-I549 HydrophobicContact CD2-CB 4.38Å; L462-I549 HydrophobicContact CD2-CD1 4.15Å; L462-I549 HydrophobicContact CD2-CG2 4.12Å; L462-I549 PolarHBondContact N-O 3.42Å; L462-V551 HydrophobicContact CB-CG2 4.08Å; L462-V551 HydrophobicContact CD1-CG2 3.85Å; L462-I704 HydrophobicContact CD2-CG2 3.71Å; L462-V708 HydrophobicContact CD1-CG2 4.23Å; L462-V708 HydrophobicContact CD2-CG2 4.01Å
463	K	88.5	Confident	76.2	Confident	92 Å²	92	42.4 Å²	42.4	40%	0.4	26%	0.257	S	S	.	.	H	α-helix	trans	-61	-47.6	171.5	-173.9	-177.3	175.7	-177.6	0	111.1	T461 S467 P546	T461-K463 PolarHBondContact O-N 3.23Å; T461-K463 WeakPolarHBondContact OG1-CB 3.3Å; T461-K463 PolarHBondContact OG1-N 3.14Å; K463-S467 WeakPolarHBondContact O-CB 3.33Å; K463-S467 PolarHBondContact O-N 3.38Å; K463-S467 PolarHBondContact O-OG 3.42Å; K463-P546 HydrophobicContact CB-CB 4Å; K463-P546 PolarHBondContact N-O 2.93Å
464	D	84.9	Confident	73.8	Confident	71 Å²	71	48 Å²	48	38%	0.38	29%	0.287	S	S	.	.	H	α-helix	trans	-67.1	-46.9	-178.6	-45.8	-44.3	0	0	0	109.9	T461 L466 S467 N468	T461-D464 VanDerWaalsContact CB-OD2 3.29Å; T461-D464 WeakPolarHBondContact CB-OD2 3.45Å; T461-D464 WeakPolarHBondContact CG2-OD2 3.23Å; T461-D464 PolarHBondContact N-OD2 2.98Å; T461-D464 PolarHBondContact O-N 3.35Å; T461-D464 VanDerWaalsContact O-N 3.1Å; T461-D464 PolarHBondContact OG1-N 3.01Å; T461-D464 PolarHBondContact OG1-OD1 3.03Å; T461-D464 PolarHBondContact OG1-OD2 2.78Å; D464-L466 PolarHBondContact O-N 3.02Å; D464-S467 PolarHBondContact O-N 3.21Å; D464-N468 PolarHBondContact O-N 3.49Å; D464-N468 PolarHBondContact O-OD1 3.17Å
465	F	86.9	Confident	71.5	Confident	1 Å²	1	51.7 Å²	51.7	0%	0.004	30%	0.301	C	S	.	.	H	α-helix	trans	-49.5	-52.1	173.5	-172.9	-75.5	0	0	0	112.7	Y459 T461 L462 S467 W471 I511 I515 V551 W711	Y459-F465 HydrophobicContact CD2-CE2 4.3Å; Y459-F465 HydrophobicContact CG-CD2 4.07Å; Y459-F465 HydrophobicContact CG-CE2 4.17Å; T461-F465 WeakPolarHBondContact O-CB 3.44Å; T461-F465 PolarHBondContact O-N 3Å; L462-F465 HydrophobicContact CD1-CB 4.46Å; L462-F465 HydrophobicContact CD1-CD1 4.29Å; L462-F465 HydrophobicContact CD1-CG 4.48Å; F465-S467 VanDerWaalsContact C-N 3.31Å; F465-S467 PolarHBondContact O-N 3.06Å; F465-W471 HydrophobicContact CD1-CH2 4.1Å; F465-W471 AromaticContact CD1-CZ2 3.63Å; F465-W471 HydrophobicContact CD1-CZ2 3.63Å; F465-W471 AromaticContact CD2-CH2 3.53Å; F465-W471 HydrophobicContact CD2-CH2 3.53Å; F465-W471 AromaticContact CD2-CZ2 3.82Å; F465-W471 HydrophobicContact CD2-CZ2 3.82Å; F465-W471 AromaticContact CE1-CH2 3.7Å; F465-W471 HydrophobicContact CE1-CH2 3.7Å; F465-W471 AromaticContact CE1-CZ2 3.47Å; F465-W471 HydrophobicContact CE1-CZ2 3.47Å; F465-W471 VanDerWaalsContact CE1-CZ2 3.47Å; F465-W471 HydrophobicContact CE1-CZ3 4.43Å; F465-W471 AromaticContact CE2-CH2 3.08Å; F465-W471 HydrophobicContact CE2-CH2 3.08Å; F465-W471 AromaticContact CE2-CZ2 3.69Å; F465-W471 HydrophobicContact CE2-CZ2 3.69Å; F465-W471 AromaticContact CE2-CZ3 3.84Å; F465-W471 HydrophobicContact CE2-CZ3 3.84Å; F465-W471 AromaticContact CG-CH2 4Å; F465-W471 HydrophobicContact CG-CH2 4Å; F465-W471 AromaticContact CG-CZ2 3.77Å; F465-W471 HydrophobicContact CG-CZ2 3.77Å; F465-W471 HydrophobicContact CZ-CE3 4.5Å; F465-W471 AromaticContact CZ-CH2 3.14Å; F465-W471 HydrophobicContact CZ-CH2 3.14Å; F465-W471 AromaticContact CZ-CZ2 3.47Å; F465-W471 HydrophobicContact CZ-CZ2 3.47Å; F465-W471 VanDerWaalsContact CZ-CZ2 3.47Å; F465-W471 AromaticContact CZ-CZ3 3.68Å; F465-W471 HydrophobicContact CZ-CZ3 3.68Å; F465-W471 WeakPolarHBondContact O-CZ2 3.24Å; F465-I511 HydrophobicContact CE1-CG2 3.92Å; F465-I511 HydrophobicContact CZ-CG2 3.49Å; F465-I511 VanDerWaalsContact CZ-CG2 3.49Å; F465-I515 HydrophobicContact CD1-CD1 4.26Å; F465-I515 HydrophobicContact CE1-CD1 3.73Å; F465-I515 HydrophobicContact CE2-CD1 4.39Å; F465-I515 HydrophobicContact CZ-CD1 3.83Å; F465-V551 HydrophobicContact CB-CG2 4.24Å; F465-V551 HydrophobicContact CD2-CB 3.76Å; F465-V551 HydrophobicContact CD2-CG1 3.62Å; F465-V551 HydrophobicContact CD2-CG2 3.88Å; F465-V551 HydrophobicContact CE2-CB 4.25Å; F465-V551 HydrophobicContact CE2-CG1 3.57Å; F465-V551 HydrophobicContact CG-CB 4.49Å; F465-V551 HydrophobicContact CG-CG2 4.13Å; F465-W711 AromaticContact CE1-CH2 3.78Å; F465-W711 HydrophobicContact CE1-CH2 3.78Å; F465-W711 AromaticContact CE1-CZ2 3.81Å; F465-W711 HydrophobicContact CE1-CZ2 3.81Å; F465-W711 HydrophobicContact CE1-CZ3 4.19Å; F465-W711 HydrophobicContact CZ-CH2 4.33Å
466	L	83.5	Confident	68.7	Low	1 Å²	1	53.9 Å²	53.9	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-76.3	-17.4	-178.7	-62.5	171.9	0	0	0	113.3	L462 D464 E707 V708 W711	L462-L466 HydrophobicContact CD1-CD1 4.03Å; L462-L466 HydrophobicContact CD1-CD2 4.33Å; L462-L466 HydrophobicContact CD1-CG 3.92Å; L462-L466 HydrophobicContact CD2-CD1 4.47Å; L462-L466 HydrophobicContact CG-CD1 3.84Å; L462-L466 HydrophobicContact CG-CG 4.18Å; L462-L466 WeakPolarHBondContact O-CB 3.24Å; L462-L466 WeakPolarHBondContact O-CG 3.15Å; L462-L466 PolarHBondContact O-N 3.37Å; D464-L466 PolarHBondContact O-N 3.02Å; L466-E707 HydrophobicContact CD1-CB 4.27Å; L466-V708 HydrophobicContact CD1-CG2 4.17Å; L466-V708 HydrophobicContact CD2-CG2 4.34Å; L466-W711 HydrophobicContact CD2-CB 3.64Å; L466-W711 HydrophobicContact CD2-CD2 3.65Å; L466-W711 HydrophobicContact CD2-CE3 4.04Å; L466-W711 HydrophobicContact CD2-CG 3.42Å; L466-W711 VanDerWaalsContact CD2-CG 3.42Å
467	S	73.9	Confident	65.8	Low	42 Å²	42	55.5 Å²	55.5	29%	0.294	33%	0.327	S	S	.	.	H	α-helix	trans	-83.3	-33.6	176.1	-58.8	0	0	0	0	112	K463 D464 F465 G469	K463-S467 WeakPolarHBondContact O-CB 3.33Å; K463-S467 PolarHBondContact O-N 3.38Å; K463-S467 PolarHBondContact O-OG 3.42Å; D464-S467 PolarHBondContact O-N 3.21Å; F465-S467 VanDerWaalsContact C-N 3.31Å; F465-S467 PolarHBondContact O-N 3.06Å; S467-G469 VanDerWaalsContact C-N 3.31Å; S467-G469 PolarHBondContact O-N 3.44Å
468	N	67.9	Low	63	Low	92 Å²	92	62.2 Å²	62.2	49%	0.492	35%	0.351	S	S	.	.			trans	-70.2	86.3	173.5	-67.9	-4.3	0	0	0	108.9	D464 D470 W471	D464-N468 PolarHBondContact O-N 3.49Å; D464-N468 PolarHBondContact O-OD1 3.17Å; N468-D470 PolarHBondContact O-N 3.05Å; N468-D470 VanDerWaalsContact O-N 3.15Å; N468-W471 VanDerWaalsContact O-CD1 3.26Å; N468-W471 PolarHBondContact O-NE1 2.86Å
469	G	50.6	Low	60.5	Low	43 Å²	43	66.1 Å²	66.1	44%	0.443	36%	0.361	S	S	.	.			trans	-69.3	-8.1	-174	0	0	0	0	0	115.4	S467 W471	S467-G469 VanDerWaalsContact C-N 3.31Å; S467-G469 PolarHBondContact O-N 3.44Å; G469-W471 PolarHBondContact O-N 2.88Å
470	D	49.7	Very low	57.8	Low	81 Å²	81	69.3 Å²	69.3	43%	0.433	38%	0.383	S	S	.	.			trans	-107.2	52.9	-160.7	-150.2	26.8	0	0	0	113.7	N468 N472 T473	N468-D470 PolarHBondContact O-N 3.05Å; N468-D470 VanDerWaalsContact O-N 3.15Å; D470-N472 PolarHBondContact O-N 3.32Å; D470-T473 PolarHBondContact O-N 2.83Å; D470-T473 PolarHBondContact O-OG1 3.34Å; D470-T473 WeakPolarHBondContact OD2-CG2 3.34Å; D470-T473 PolarHBondContact OD2-OG1 2.9Å
471	W	52.6	Low	54.9	Low	21 Å²	21	74.1 Å²	74.1	8%	0.08	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-7.7	179.9	-69.2	78.1	0	0	0	115	Y459 F465 N468 G469 I511 W711	Y459-W471 HydrophobicContact CD1-CH2 4.14Å; Y459-W471 HydrophobicContact CE1-CH2 4.27Å; Y459-W471 HydrophobicContact CE1-CZ3 4.27Å; F465-W471 HydrophobicContact CD1-CH2 4.1Å; F465-W471 AromaticContact CD1-CZ2 3.63Å; F465-W471 HydrophobicContact CD1-CZ2 3.63Å; F465-W471 AromaticContact CD2-CH2 3.53Å; F465-W471 HydrophobicContact CD2-CH2 3.53Å; F465-W471 AromaticContact CD2-CZ2 3.82Å; F465-W471 HydrophobicContact CD2-CZ2 3.82Å; F465-W471 AromaticContact CE1-CH2 3.7Å; F465-W471 HydrophobicContact CE1-CH2 3.7Å; F465-W471 AromaticContact CE1-CZ2 3.47Å; F465-W471 HydrophobicContact CE1-CZ2 3.47Å; F465-W471 VanDerWaalsContact CE1-CZ2 3.47Å; F465-W471 HydrophobicContact CE1-CZ3 4.43Å; F465-W471 AromaticContact CE2-CH2 3.08Å; F465-W471 HydrophobicContact CE2-CH2 3.08Å; F465-W471 AromaticContact CE2-CZ2 3.69Å; F465-W471 HydrophobicContact CE2-CZ2 3.69Å; F465-W471 AromaticContact CE2-CZ3 3.84Å; F465-W471 HydrophobicContact CE2-CZ3 3.84Å; F465-W471 AromaticContact CG-CH2 4Å; F465-W471 HydrophobicContact CG-CH2 4Å; F465-W471 AromaticContact CG-CZ2 3.77Å; F465-W471 HydrophobicContact CG-CZ2 3.77Å; F465-W471 HydrophobicContact CZ-CE3 4.5Å; F465-W471 AromaticContact CZ-CH2 3.14Å; F465-W471 HydrophobicContact CZ-CH2 3.14Å; F465-W471 AromaticContact CZ-CZ2 3.47Å; F465-W471 HydrophobicContact CZ-CZ2 3.47Å; F465-W471 VanDerWaalsContact CZ-CZ2 3.47Å; F465-W471 AromaticContact CZ-CZ3 3.68Å; F465-W471 HydrophobicContact CZ-CZ3 3.68Å; F465-W471 WeakPolarHBondContact O-CZ2 3.24Å; N468-W471 VanDerWaalsContact O-CD1 3.26Å; N468-W471 PolarHBondContact O-NE1 2.86Å; G469-W471 PolarHBondContact O-N 2.88Å; W471-I511 HydrophobicContact CE3-CD1 4.21Å; W471-I511 HydrophobicContact CZ3-CD1 4.33Å; W471-W711 AromaticContact CD1-CZ2 3.66Å; W471-W711 AromaticContact CD1-NE1 3.76Å; W471-W711 AromaticContact CD2-CZ2 3.75Å; W471-W711 HydrophobicContact CD2-CZ2 3.75Å; W471-W711 AromaticContact CE2-CZ2 3.57Å; W471-W711 AromaticContact CG-CZ2 3.89Å; W471-W711 HydrophobicContact CG-CZ2 3.89Å; W471-W711 HydrophobicContact CZ2-CZ2 4.3Å; W471-W711 AromaticContact NE1-CE2 3.7Å; W471-W711 AromaticContact NE1-CZ2 3.44Å; W471-W711 AromaticContact NE1-NE1 3.39Å
472	N	41	Very low	51.9	Low	72 Å²	72	79.9 Å²	79.9	39%	0.385	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-17.3	176.7	-71.2	11.7	0	0	0	113	D470 R508 L735	D470-N472 PolarHBondContact O-N 3.32Å; N472-R508 PolarHBondContact OD1-NH2 2.89Å; N472-L735 WeakPolarHBondContact ND2-CD2 3.43Å
473	T	37.7	Very low	49	Very low	92 Å²	92	83.8 Å²	83.8	56%	0.564	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-26	-178.8	49.2	0	0	0	0	113.4	D470	D470-T473 PolarHBondContact O-N 2.83Å; D470-T473 PolarHBondContact O-OG1 3.34Å; D470-T473 WeakPolarHBondContact OD2-CG2 3.34Å; D470-T473 PolarHBondContact OD2-OG1 2.9Å
474	D	36.6	Very low	46.3	Very low	118 Å²	118	89 Å²	89	63%	0.631	49%	0.488	S	S	*	.	S	Bend	trans	-82.7	-10.1	173.8	-84.8	-26.7	0	0	0	114.3
475	F	39.3	Very low	43.7	Very low	82 Å²	82	91.2 Å²	91.2	36%	0.36	50%	0.499	S	S	.	.	S	Bend	trans	-88.6	123.1	158.8	-89.2	-90.7	0	0	0	108	S477 I507 W555	F475-S477 PolarHBondContact O-N 3.08Å; F475-S477 VanDerWaalsContact O-N 3.15Å; F475-I507 HydrophobicContact CE2-CG2 4.17Å; F475-I507 HydrophobicContact CZ-CD1 4.45Å; F475-I507 HydrophobicContact CZ-CG2 4.1Å; F475-W555 AromaticContact CZ-CZ2 3.93Å; F475-W555 HydrophobicContact CZ-CZ2 3.93Å
476	P	27.7	Very low	41	Very low	72 Å²	72	98.1 Å²	98.1	47%	0.468	53%	0.529	S	S	.	.			trans	-53.9	125.8	169.1	-22.5	32.6	0	0	0	108.8	Y478 L485	P476-Y478 PolarHBondContact O-N 3.34Å; P476-L485 HydrophobicContact CB-CD1 4.29Å; P476-L485 HydrophobicContact CG-CD1 4.23Å
477	S	28.6	Very low	38.5	Very low	79 Å²	79	104.1 Å²	104.1	55%	0.552	56%	0.561	S	S	*	*			trans	-55.6	106.3	170.3	43.9	0	0	0	0	107.6	F475 L479	F475-S477 PolarHBondContact O-N 3.08Å; F475-S477 VanDerWaalsContact O-N 3.15Å; S477-L479 PolarHBondContact O-N 2.71Å
478	Y	30.6	Very low	36.3	Very low	158 Å²	158	110.1 Å²	110.1	62%	0.62	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	26.4	-166.4	-135.9	-83.5	0	0	0	113	P476 V490	P476-Y478 PolarHBondContact O-N 3.34Å; Y478-V490 WeakPolarHBondContact OH-CG1 3.45Å
479	L	30.4	Very low	34.4	Very low	150 Å²	150	111.5 Å²	111.5	79%	0.785	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.4	-21.5	-161.7	-77.2	164.4	0	0	0	114.9	S477	S477-L479 PolarHBondContact O-N 2.71Å
480	D	30.2	Very low	33.4	Very low	142 Å²	142	113.4 Å²	113.4	76%	0.759	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.4	-39.1	-177.1	-87.5	-53.6	0	0	0	117.4	N482	D480-N482 PolarHBondContact O-N 3.41Å
481	D	28.5	Very low	32.2	Very low	128 Å²	128	112.2 Å²	112.2	68%	0.684	59%	0.588	S	S	*	*			trans	-89.9	50.6	-169	-91.4	-47.3	0	0	0	116	A483	D481-A483 PolarHBondContact O-N 3.32Å
482	N	28.9	Very low	31.1	Very low	141 Å²	141	114.7 Å²	114.7	75%	0.754	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	13.4	-171.9	-91.7	-52.8	0	0	0	117.5	D480	D480-N482 PolarHBondContact O-N 3.41Å
483	A	31.3	Very low	30.4	Very low	82 Å²	82	115.1 Å²	115.1	68%	0.678	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	-27.8	-170.2	0	0	0	0	0	116.6	D481	D481-A483 PolarHBondContact O-N 3.32Å
484	K	30.7	Very low	30.1	Very low	202 Å²	202	116.5 Å²	116.5	88%	0.878	63%	0.63	S	S	*	*	S	Bend	trans	-121.6	-5.3	-163.8	-72.3	179.9	179.6	171.5	0	117.3
485	L	31.7	Very low	29.7	Very low	116 Å²	116	117.4 Å²	117.4	61%	0.607	64%	0.635	S	S	*	*			trans	-110	16.7	-171.4	-105.2	156.6	0	0	0	115.9	P476 N487	P476-L485 HydrophobicContact CB-CD1 4.29Å; P476-L485 HydrophobicContact CG-CD1 4.23Å; L485-N487 PolarHBondContact O-N 2.95Å
486	K	29.6	Very low	29.2	Very low	146 Å²	146	116.5 Å²	116.5	64%	0.635	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	5.7	-172.7	-80	-176.3	174.2	176.2	0	117.7
487	N	30.1	Very low	29.4	Very low	127 Å²	127	116.5 Å²	116.5	68%	0.679	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	2.1	-170.2	-73.7	-3.8	0	0	0	115.9	L485	L485-N487 PolarHBondContact O-N 2.95Å
488	F	28.8	Very low	29.7	Very low	168 Å²	168	118.3 Å²	118.3	74%	0.737	63%	0.634	S	S	*	*	S	Bend	trans	-103.3	157.9	163	-87.3	-89.6	0	0	0	110.9	V490	F488-V490 VanDerWaalsContact C-N 3.25Å; F488-V490 PolarHBondContact O-N 3.45Å
489	D	27.1	Very low	29.8	Very low	121 Å²	121	114.6 Å²	114.6	65%	0.647	63%	0.631	S	S	*	*	S	Bend	trans	-71.4	61.1	-163.1	-115.7	-42.2	0	0	0	115.7	K162	K162-D489 HydrophobicContact CD-CB 4.42Å; K162-D489 VanDerWaalsContact CD-OD2 3.22Å; K162-D489 WeakPolarHBondContact CD-OD2 3.1Å; K162-D489 VanDerWaalsContact CE-CA 3.48Å; K162-D489 WeakPolarHBondContact CE-OD1 3.25Å; K162-D489 WeakPolarHBondContact CE-OD2 3.36Å; K162-D489 VanDerWaalsContact NZ-CG 3.31Å; K162-D489 IonicContact NZ-OD1 2.7Å; K162-D489 PolarHBondContact NZ-OD1 3.11Å; K162-D489 IonicContact NZ-OD2 3.54Å
490	V	29.3	Very low	30	Very low	84 Å²	84	117.1 Å²	117.1	51%	0.509	63%	0.63	S	S	.	*			trans	-140.4	45.3	-176.1	-152.9	0	0	0	0	111.5	Y478 F488	Y478-V490 WeakPolarHBondContact OH-CG1 3.45Å; F488-V490 VanDerWaalsContact C-N 3.25Å; F488-V490 PolarHBondContact O-N 3.45Å
491	T	26.5	Very low	30.4	Very low	55 Å²	55	112.1 Å²	112.1	34%	0.337	61%	0.608	S	S	.	*			trans	-122.7	9.4	-176.6	47	0	0	0	0	115.7	E158 G493	E158-T491 VanDerWaalsContact OE1-CB 3.22Å; E158-T491 WeakPolarHBondContact OE1-CB 3.49Å; E158-T491 PolarHBondContact OE1-OG1 2.97Å; T491-G493 PolarHBondContact O-N 2.92Å
492	S	28.2	Very low	31.2	Very low	73 Å²	73	110.9 Å²	110.9	51%	0.51	60%	0.602	S	S	.	*			trans	-74.9	91.5	158.9	60.2	0	0	0	0	109.8	Q494	S492-Q494 PolarHBondContact O-N 3.44Å
493	G	27.4	Very low	32.8	Very low	81 Å²	81	106.8 Å²	106.8	84%	0.835	58%	0.58	S	S	*	*			trans	-67	24.2	177.5	0	0	0	0	0	115.6	T491	T491-G493 PolarHBondContact O-N 2.92Å
494	Q	29.7	Very low	34.5	Very low	121 Å²	121	104.5 Å²	104.5	57%	0.565	56%	0.561	S	S	*	*	S	Bend	trans	-136.6	120.4	174.7	-72.1	170.4	-72.9	0	0	107.3	S492	S492-Q494 PolarHBondContact O-N 3.44Å
495	N	28.1	Very low	36.4	Very low	138 Å²	138	96.1 Å²	96.1	74%	0.738	53%	0.526	S	S	*	.			trans	55.8	67.8	171.2	-59.9	-11.3	0	0	0	117.6	P497	N495-P497 WeakPolarHBondContact O-CD 3.43Å
496	C	29.5	Very low	38.2	Very low	63 Å²	63	91 Å²	91	43%	0.426	50%	0.501	S	S	.	.			trans	-77.8	117.3	150.6	-175.2	0	0	0	0	108.6	Y498	C496-Y498 PolarHBondContact O-N 3.35Å
497	P	32	Very low	40.5	Very low	72 Å²	72	86 Å²	86	47%	0.468	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.7	-170.7	-23.2	33.4	0	0	0	115.4	N495 E1005	N495-P497 WeakPolarHBondContact O-CD 3.43Å; P497-E1005 HydrophobicContact CB-CG 4.36Å; P497-E1005 WeakPolarHBondContact CB-OE1 3.46Å
498	Y	35.8	Very low	43	Very low	116 Å²	116	81.1 Å²	81.1	46%	0.455	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-1.4	-161.5	-53.7	-63.5	0	0	0	115	C496 R500 N502	C496-Y498 PolarHBondContact O-N 3.35Å; Y498-R500 VanDerWaalsContact C-N 3.28Å; Y498-R500 PolarHBondContact O-N 3.48Å; Y498-N502 PolarHBondContact O-OD1 2.93Å
499	S	31.6	Very low	45.6	Very low	80 Å²	80	73.2 Å²	73.2	56%	0.559	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-12.2	-168.4	57.2	0	0	0	0	116.3	N502	S499-N502 PolarHBondContact O-ND2 2.98Å
500	R	35.4	Very low	48.3	Very low	204 Å²	204	71.3 Å²	71.3	77%	0.77	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	1.6	-177	-91.6	178.5	168.4	157.9	-3.1	115.8	Y498	Y498-R500 VanDerWaalsContact C-N 3.28Å; Y498-R500 PolarHBondContact O-N 3.48Å
501	A	37.9	Very low	51.2	Low	37 Å²	37	67.4 Å²	67.4	31%	0.306	38%	0.378	S	S	.	.			trans	-110.3	22.5	174	0	0	0	0	0	113.1	N503 M1001	A501-N503 PolarHBondContact O-N 3.12Å; A501-M1001 HydrophobicContact CB-CE 3.74Å
502	N	46.5	Very low	54.3	Low	101 Å²	101	64.8 Å²	64.8	54%	0.54	36%	0.362	S	S	.	.			trans	-73.9	41.9	-169.3	-75.8	-7.2	0	0	0	115.5	Y498 S499	Y498-N502 PolarHBondContact O-OD1 2.93Å; S499-N502 PolarHBondContact O-ND2 2.98Å
503	N	60.8	Low	57.3	Low	56 Å²	56	61.5 Å²	61.5	30%	0.299	34%	0.339	S	S	.	.			trans	-87.6	128.4	156.6	178	-4.4	0	0	0	108.2	A501 D505 G506 I507 I954	A501-N503 PolarHBondContact O-N 3.12Å; N503-D505 PolarHBondContact O-N 2.73Å; N503-D505 PolarHBondContact OD1-N 2.9Å; N503-G506 PolarHBondContact O-N 3.37Å; N503-I507 PolarHBondContact O-N 2.96Å; N503-I954 HydrophobicContact CB-CD1 3.91Å
504	A	68.4	Low	60.3	Low	34 Å²	34	59 Å²	59	28%	0.281	31%	0.305	S	S	.	.	H	α-helix	trans	-50.2	-33.1	176.1	0	0	0	0	0	113.2	I507 R508	A504-I507 PolarHBondContact O-N 3.4Å; A504-R508 WeakPolarHBondContact O-CG 3.22Å; A504-R508 PolarHBondContact O-N 3.29Å
505	D	69.9	Low	63.3	Low	26 Å²	26	53.2 Å²	53.2	14%	0.139	28%	0.278	C	S	.	.	H	α-helix	trans	-70	-32.8	176.4	-71.2	-29.9	0	0	0	113.6	N503 R508 L509 R738 I954	N503-D505 PolarHBondContact O-N 2.73Å; N503-D505 PolarHBondContact OD1-N 2.9Å; D505-R508 PolarHBondContact O-N 3Å; D505-R508 IonicContact OD1-NH1 3.89Å; D505-R508 PolarHBondContact OD1-NH1 3.4Å; D505-L509 WeakPolarHBondContact O-CG 3.42Å; D505-L509 PolarHBondContact O-N 2.95Å; D505-R738 IonicContact OD1-CZ 3.76Å; D505-R738 VanDerWaalsContact OD1-CZ 3.3Å; D505-R738 IonicContact OD1-NH1 3.55Å; D505-R738 PolarHBondContact OD1-NH1 2.62Å; D505-R738 IonicContact OD1-NH2 3.21Å; D505-R738 PolarHBondContact OD1-NH2 3.01Å; D505-R738 IonicContact OD2-NH2 3.26Å; D505-I954 HydrophobicContact CB-CG2 4.25Å
506	G	70.4	Confident	66.5	Low	9 Å²	9	46.7 Å²	46.7	9%	0.093	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-38.6	174.4	0	0	0	0	0	112.2	N503 L509 R510	N503-G506 PolarHBondContact O-N 3.37Å; G506-L509 PolarHBondContact O-N 2.98Å; G506-R510 PolarHBondContact O-N 3.42Å; G506-R510 VanDerWaalsContact O-N 3.14Å
507	I	77.5	Confident	69.5	Low	40 Å²	40	44.8 Å²	44.8	21%	0.205	23%	0.229	C	C	.	.	H	α-helix	trans	-64.7	-46.1	173.4	-61.3	174.9	0	0	0	110.3	F475 N503 A504 L509 R510 I511	F475-I507 HydrophobicContact CE2-CG2 4.17Å; F475-I507 HydrophobicContact CZ-CD1 4.45Å; F475-I507 HydrophobicContact CZ-CG2 4.1Å; N503-I507 PolarHBondContact O-N 2.96Å; A504-I507 PolarHBondContact O-N 3.4Å; I507-L509 VanDerWaalsContact C-N 3.34Å; I507-L509 PolarHBondContact O-N 2.89Å; I507-R510 PolarHBondContact O-N 3.17Å; I507-R510 VanDerWaalsContact O-N 3.12Å; I507-I511 HydrophobicContact CG2-CD1 3.88Å; I507-I511 HydrophobicContact CG2-CG1 4.42Å; I507-I511 WeakPolarHBondContact O-CG1 3.37Å; I507-I511 PolarHBondContact O-N 3.12Å
508	R	82	Confident	72.5	Confident	25 Å²	25	41.4 Å²	41.4	9%	0.094	21%	0.207	C	C	.	.	H	α-helix	trans	-56.9	-42.8	175.4	-75.2	177	-175.6	114.9	10.6	112.7	N472 A504 D505 I511 L512 W711 A712	N472-R508 PolarHBondContact OD1-NH2 2.89Å; A504-R508 WeakPolarHBondContact O-CG 3.22Å; A504-R508 PolarHBondContact O-N 3.29Å; D505-R508 PolarHBondContact O-N 3Å; D505-R508 IonicContact OD1-NH1 3.89Å; D505-R508 PolarHBondContact OD1-NH1 3.4Å; R508-I511 PolarHBondContact O-N 3.27Å; R508-L512 WeakPolarHBondContact O-CB 3.42Å; R508-L512 PolarHBondContact O-N 3.21Å; R508-W711 HydrophobicContact CG-CH2 4.21Å; R508-A712 HydrophobicContact CB-CB 4.47Å
509	L	84.3	Confident	75.4	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-41.9	174.9	-73.6	-172.2	0	0	0	112.6	D505 G506 I507 L512 L513 L713 L957 Q958 I961 F997	D505-L509 WeakPolarHBondContact O-CG 3.42Å; D505-L509 PolarHBondContact O-N 2.95Å; G506-L509 PolarHBondContact O-N 2.98Å; I507-L509 VanDerWaalsContact C-N 3.34Å; I507-L509 PolarHBondContact O-N 2.89Å; L509-L512 HydrophobicContact CD2-CD2 4.32Å; L509-L512 WeakPolarHBondContact O-CB 3.39Å; L509-L512 PolarHBondContact O-N 3.01Å; L509-L513 WeakPolarHBondContact O-CG 3.44Å; L509-L513 PolarHBondContact O-N 2.93Å; L509-L713 HydrophobicContact CD2-CD2 3.89Å; L509-L957 HydrophobicContact CD1-CB 3.99Å; L509-Q958 HydrophobicContact CD1-CG 3.87Å; L509-Q958 HydrophobicContact CD2-CG 4.04Å; L509-Q958 HydrophobicContact CG-CG 4.21Å; L509-I961 HydrophobicContact CD1-CD1 4.14Å; L509-I961 HydrophobicContact CD2-CD1 3.8Å; L509-I961 HydrophobicContact CG-CD1 4.39Å; L509-F997 HydrophobicContact CB-CE2 4.01Å; L509-F997 HydrophobicContact CB-CZ 4.3Å; L509-F997 HydrophobicContact CD1-CE2 4.45Å
510	R	83.7	Confident	78.5	Confident	80 Å²	80	32.1 Å²	32.1	30%	0.302	16%	0.159	S	C	.	.	H	α-helix	trans	-63.9	-43.1	177.3	-172.3	170.2	-172.6	-137.6	2.5	111.7	G506 I507 L513 E514 F997	G506-R510 PolarHBondContact O-N 3.42Å; G506-R510 VanDerWaalsContact O-N 3.14Å; I507-R510 PolarHBondContact O-N 3.17Å; I507-R510 VanDerWaalsContact O-N 3.12Å; R510-L513 PolarHBondContact O-N 3.35Å; R510-E514 PolarHBondContact O-N 2.85Å; R510-F997 HydrophobicContact CB-CE1 3.83Å; R510-F997 HydrophobicContact CB-CZ 3.88Å; R510-F997 HydrophobicContact CG-CE1 3.95Å; R510-F997 HydrophobicContact CG-CZ 4.49Å
511	I	89.6	Confident	81.4	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-48.1	175.7	-68.2	171.1	0	0	0	110.7	F465 W471 I507 R508 L513 E514 I515 W555 W711	F465-I511 HydrophobicContact CE1-CG2 3.92Å; F465-I511 HydrophobicContact CZ-CG2 3.49Å; F465-I511 VanDerWaalsContact CZ-CG2 3.49Å; W471-I511 HydrophobicContact CE3-CD1 4.21Å; W471-I511 HydrophobicContact CZ3-CD1 4.33Å; I507-I511 HydrophobicContact CG2-CD1 3.88Å; I507-I511 HydrophobicContact CG2-CG1 4.42Å; I507-I511 WeakPolarHBondContact O-CG1 3.37Å; I507-I511 PolarHBondContact O-N 3.12Å; R508-I511 PolarHBondContact O-N 3.27Å; I511-L513 VanDerWaalsContact C-N 3.31Å; I511-L513 PolarHBondContact O-N 3.4Å; I511-E514 PolarHBondContact O-N 3.25Å; I511-I515 HydrophobicContact CG2-CD1 3.57Å; I511-I515 HydrophobicContact CG2-CG1 4.19Å; I511-I515 WeakPolarHBondContact O-CB 3.48Å; I511-I515 WeakPolarHBondContact O-CG1 3.48Å; I511-I515 PolarHBondContact O-N 2.88Å; I511-W555 HydrophobicContact CD1-CD2 4.34Å; I511-W555 HydrophobicContact CD1-CG 4.45Å; I511-W555 HydrophobicContact CG1-CB 4.2Å; I511-W555 HydrophobicContact CG1-CD2 3.72Å; I511-W555 HydrophobicContact CG1-CE3 3.91Å; I511-W555 HydrophobicContact CG1-CG 3.83Å; I511-W555 HydrophobicContact CG2-CB 4.47Å; I511-W711 HydrophobicContact CB-CH2 4.25Å; I511-W711 HydrophobicContact CB-CZ3 4.37Å; I511-W711 HydrophobicContact CD1-CH2 4.36Å; I511-W711 HydrophobicContact CG2-CH2 3.73Å; I511-W711 HydrophobicContact CG2-CZ3 3.81Å
512	L	91.1	Very high	84.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-51.5	-50.7	175.1	166.3	64.8	0	0	0	111.3	R508 L509 T516 V708 V709 A712 I961	R508-L512 WeakPolarHBondContact O-CB 3.42Å; R508-L512 PolarHBondContact O-N 3.21Å; L509-L512 HydrophobicContact CD2-CD2 4.32Å; L509-L512 WeakPolarHBondContact O-CB 3.39Å; L509-L512 PolarHBondContact O-N 3.01Å; L512-T516 HydrophobicContact CD1-CG2 3.77Å; L512-T516 WeakPolarHBondContact O-CB 3.49Å; L512-T516 WeakPolarHBondContact O-CG2 3.41Å; L512-T516 PolarHBondContact O-N 3.49Å; L512-T516 PolarHBondContact O-OG1 3.07Å; L512-V708 HydrophobicContact CD1-CB 4.18Å; L512-V708 HydrophobicContact CD1-CG1 3.63Å; L512-V709 HydrophobicContact CD1-CB 4.44Å; L512-V709 HydrophobicContact CD1-CG2 3.75Å; L512-A712 HydrophobicContact CB-CB 3.7Å; L512-A712 HydrophobicContact CD1-CB 4.35Å; L512-A712 HydrophobicContact CD2-CB 3.91Å; L512-A712 HydrophobicContact CG-CB 4.19Å; L512-I961 HydrophobicContact CD2-CG2 3.68Å
513	L	90.8	Very high	86.5	Confident	4 Å²	4	18.5 Å²	18.5	2%	0.021	10%	0.095	C	C	.	.	H	α-helix	trans	-67.8	-38	-177.6	-71	175	0	0	0	112.6	L509 R510 I511 T516 N517 I961 I993 Y994 F997	L509-L513 WeakPolarHBondContact O-CG 3.44Å; L509-L513 PolarHBondContact O-N 2.93Å; R510-L513 PolarHBondContact O-N 3.35Å; I511-L513 VanDerWaalsContact C-N 3.31Å; I511-L513 PolarHBondContact O-N 3.4Å; L513-T516 PolarHBondContact O-OG1 3.1Å; L513-N517 WeakPolarHBondContact O-CB 3.46Å; L513-N517 PolarHBondContact O-N 3.34Å; L513-I961 HydrophobicContact CD1-CD1 4.06Å; L513-I961 HydrophobicContact CD2-CD1 4.44Å; L513-I961 HydrophobicContact CG-CD1 4.38Å; L513-I993 HydrophobicContact CD2-CG2 4.12Å; L513-Y994 HydrophobicContact CB-CD2 4.12Å; L513-F997 HydrophobicContact CD1-CB 3.56Å; L513-F997 HydrophobicContact CD1-CD1 3.68Å; L513-F997 HydrophobicContact CD1-CD2 3.56Å; L513-F997 HydrophobicContact CD1-CE1 4.23Å; L513-F997 HydrophobicContact CD1-CE2 4.14Å; L513-F997 HydrophobicContact CD1-CG 3.3Å; L513-F997 HydrophobicContact CD1-CZ 4.44Å
514	E	91.2	Very high	88.2	Confident	28 Å²	28	16.6 Å²	16.6	13%	0.131	9%	0.086	C	C	.	.	H	α-helix	trans	-71.8	-43.5	176.8	-174.3	55.4	-152.3	0	0	112.3	R413 R510 I511 T516 S518 S556 Y994	R413-E514 IonicContact CZ-OE1 2.71Å; R413-E514 IonicContact NH2-OE1 2.68Å; R413-E514 PolarHBondContact NH2-OE1 3.47Å; R510-E514 PolarHBondContact O-N 2.85Å; I511-E514 PolarHBondContact O-N 3.25Å; E514-T516 PolarHBondContact O-N 2.72Å; E514-S518 WeakPolarHBondContact O-CB 3.48Å; E514-S518 PolarHBondContact O-N 3.05Å; E514-S518 PolarHBondContact O-OG 2.77Å; E514-S556 WeakPolarHBondContact OE1-CB 3.48Å; E514-Y994 WeakPolarHBondContact OE2-CE2 3.32Å; E514-Y994 PolarHBondContact OE2-OH 3.09Å
515	I	93.8	Very high	89.4	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.6	-48.6	175.4	-69.6	176.6	0	0	0	110.4	L462 F465 I511 S518 L519 W555 V708	L462-I515 HydrophobicContact CD1-CD1 4.03Å; L462-I515 HydrophobicContact CD1-CG2 4.08Å; L462-I515 HydrophobicContact CD2-CG2 4.4Å; F465-I515 HydrophobicContact CD1-CD1 4.26Å; F465-I515 HydrophobicContact CE1-CD1 3.73Å; F465-I515 HydrophobicContact CE2-CD1 4.39Å; F465-I515 HydrophobicContact CZ-CD1 3.83Å; I511-I515 HydrophobicContact CG2-CD1 3.57Å; I511-I515 HydrophobicContact CG2-CG1 4.19Å; I511-I515 WeakPolarHBondContact O-CB 3.48Å; I511-I515 WeakPolarHBondContact O-CG1 3.48Å; I511-I515 PolarHBondContact O-N 2.88Å; I515-S518 PolarHBondContact O-OG 3.37Å; I515-S518 VanDerWaalsContact O-OG 3.12Å; I515-L519 WeakPolarHBondContact O-CB 3.4Å; I515-L519 PolarHBondContact O-N 3.47Å; I515-W555 WeakPolarHBondContact CG1-O 3.37Å; I515-V708 HydrophobicContact CB-CG1 4.4Å; I515-V708 HydrophobicContact CD1-CG1 4.48Å; I515-V708 HydrophobicContact CG2-CG1 4.15Å; I515-V708 HydrophobicContact CG2-CG2 4.09Å
516	T	94.7	Very high	90.6	Very high	2 Å²	2	15 Å²	15	1%	0.012	7%	0.071	C	C	.	.	H	α-helix	trans	-68.8	-43.1	-176	55.9	0	0	0	0	112	L512 L513 E514 V520 L705 V708 F965	L512-T516 HydrophobicContact CD1-CG2 3.77Å; L512-T516 WeakPolarHBondContact O-CB 3.49Å; L512-T516 WeakPolarHBondContact O-CG2 3.41Å; L512-T516 PolarHBondContact O-N 3.49Å; L512-T516 PolarHBondContact O-OG1 3.07Å; L513-T516 PolarHBondContact O-OG1 3.1Å; E514-T516 PolarHBondContact O-N 2.72Å; T516-V520 WeakPolarHBondContact O-CB 3.33Å; T516-V520 VanDerWaalsContact O-CG2 3.24Å; T516-V520 WeakPolarHBondContact O-CG2 3.48Å; T516-V520 PolarHBondContact O-N 2.87Å; T516-V520 VanDerWaalsContact O-N 3.12Å; T516-L705 HydrophobicContact CG2-CD2 3.55Å; T516-V708 HydrophobicContact CG2-CG1 4.47Å; T516-F965 HydrophobicContact CG2-CE1 4.38Å; T516-F965 HydrophobicContact CG2-CZ 3.91Å
517	N	93	Very high	91.8	Very high	23 Å²	23	15.4 Å²	15.4	12%	0.123	7%	0.071	C	C	.	.	H	α-helix	trans	-63.1	-47.7	175.3	-178.5	32.8	0	0	0	112.1	L513 V520 Q521 Y994	L513-N517 WeakPolarHBondContact O-CB 3.46Å; L513-N517 PolarHBondContact O-N 3.34Å; N517-V520 PolarHBondContact O-N 2.93Å; N517-Q521 VanDerWaalsContact O-CB 3.3Å; N517-Q521 WeakPolarHBondContact O-CB 3.39Å; N517-Q521 PolarHBondContact O-N 3.07Å; N517-Y994 HydrophobicContact CB-CD2 4.07Å; N517-Y994 HydrophobicContact CB-CE2 4.31Å
518	S	94.5	Very high	92.4	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-66.9	-36.8	-179.5	59.4	0	0	0	0	113.1	E514 I515 Q521 G522 C557	E514-S518 WeakPolarHBondContact O-CB 3.48Å; E514-S518 PolarHBondContact O-N 3.05Å; E514-S518 PolarHBondContact O-OG 2.77Å; I515-S518 PolarHBondContact O-OG 3.37Å; I515-S518 VanDerWaalsContact O-OG 3.12Å; S518-Q521 PolarHBondContact O-N 3.45Å; S518-G522 PolarHBondContact O-N 3.15Å; S518-C557 PolarHBondContact OG-N 3Å; S518-C557 PolarHBondContact OG-SG 2.79Å; S518-C557 VanDerWaalsContact OG-SG 3.4Å
519	L	96.9	Very high	92.8	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-63.4	-50.3	175.1	-178.9	55.9	0	0	0	111.5	I515 Q521 G522 L523 I549 C557 I559 L701 I704	I515-L519 WeakPolarHBondContact O-CB 3.4Å; I515-L519 PolarHBondContact O-N 3.47Å; L519-Q521 VanDerWaalsContact C-N 3.3Å; L519-Q521 PolarHBondContact O-N 2.89Å; L519-G522 PolarHBondContact O-N 3.39Å; L519-G522 VanDerWaalsContact O-N 3.11Å; L519-L523 PolarHBondContact O-N 2.83Å; L519-I549 HydrophobicContact CD1-CD1 3.5Å; L519-I549 VanDerWaalsContact CD1-CD1 3.5Å; L519-I549 HydrophobicContact CD1-CG1 3.87Å; L519-I549 HydrophobicContact CD1-CG2 4.3Å; L519-I549 HydrophobicContact CD2-CD1 3.92Å; L519-I549 HydrophobicContact CG-CD1 4.38Å; L519-C557 WeakPolarHBondContact CA-SG 2.98Å; L519-C557 VanDerWaalsContact CB-SG 3.52Å; L519-C557 PolarHBondContact N-SG 2.95Å; L519-I559 HydrophobicContact CD1-CD1 4.07Å; L519-I559 HydrophobicContact CD1-CG1 3.87Å; L519-L701 HydrophobicContact CD2-CD1 3.58Å; L519-L701 HydrophobicContact CG-CD1 3.74Å; L519-I704 HydrophobicContact CD2-CB 4.47Å; L519-I704 HydrophobicContact CD2-CG2 3.73Å
520	V	96.3	Very high	92.8	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-66.1	-35.5	180	176.2	0	0	0	0	110.9	T516 N517 C524 L701 L705 A983 I986 K987 L990	T516-V520 WeakPolarHBondContact O-CB 3.33Å; T516-V520 VanDerWaalsContact O-CG2 3.24Å; T516-V520 WeakPolarHBondContact O-CG2 3.48Å; T516-V520 PolarHBondContact O-N 2.87Å; T516-V520 VanDerWaalsContact O-N 3.12Å; N517-V520 PolarHBondContact O-N 2.93Å; V520-C524 WeakPolarHBondContact O-CB 3.24Å; V520-C524 PolarHBondContact O-N 2.83Å; V520-L701 HydrophobicContact CG2-CD1 4.12Å; V520-L701 HydrophobicContact CG2-CD2 4.06Å; V520-L705 HydrophobicContact CG2-CD2 4.41Å; V520-A983 WeakPolarHBondContact CG1-O 3.42Å; V520-I986 HydrophobicContact CG1-CB 4.13Å; V520-I986 HydrophobicContact CG1-CG2 3.93Å; V520-I986 HydrophobicContact CG2-CG2 3.85Å; V520-K987 HydrophobicContact CG1-CB 3.73Å; V520-K987 HydrophobicContact CG1-CG 4.39Å; V520-L990 HydrophobicContact CG2-CD1 4.07Å
521	Q	95	Very high	92.5	Very high	56 Å²	56	25.5 Å²	25.5	26%	0.262	14%	0.142	S	C	.	.	H	α-helix	trans	-62.3	-41.3	171.1	-175.2	-174.3	15.4	0	0	112	R413 N517 S518 L519 F525	R413-Q521 HydrophobicContact CG-CB 4.17Å; R413-Q521 HydrophobicContact CG-CG 3.99Å; N517-Q521 VanDerWaalsContact O-CB 3.3Å; N517-Q521 WeakPolarHBondContact O-CB 3.39Å; N517-Q521 PolarHBondContact O-N 3.07Å; S518-Q521 PolarHBondContact O-N 3.45Å; L519-Q521 VanDerWaalsContact C-N 3.3Å; L519-Q521 PolarHBondContact O-N 2.89Å; Q521-F525 WeakPolarHBondContact O-CB 3.43Å; Q521-F525 PolarHBondContact O-N 2.71Å
522	G	95.6	Very high	91.6	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.3	-48.5	174.8	0	0	0	0	0	113	R413 S518 L519 F525 L526	R413-G522 VanDerWaalsContact CB-CA 3.43Å; S518-G522 PolarHBondContact O-N 3.15Å; L519-G522 PolarHBondContact O-N 3.39Å; L519-G522 VanDerWaalsContact O-N 3.11Å; G522-F525 WeakPolarHBondContact O-CB 3.37Å; G522-F525 PolarHBondContact O-N 2.97Å; G522-L526 PolarHBondContact O-N 3.31Å
523	L	97.1	Very high	90.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-41.2	179.2	-169.2	66	0	0	0	111.5	L519 F525 L526 H527 L544 I559 D697 I698 L701 A983	L519-L523 PolarHBondContact O-N 2.83Å; L523-F525 VanDerWaalsContact C-N 3.28Å; L523-F525 PolarHBondContact O-N 3.5Å; L523-L526 PolarHBondContact O-N 2.88Å; L523-H527 WeakPolarHBondContact O-CB 3.31Å; L523-H527 PolarHBondContact O-N 3.04Å; L523-L544 HydrophobicContact CD1-CD2 4.26Å; L523-L544 HydrophobicContact CD2-CD2 4.16Å; L523-I559 HydrophobicContact CB-CD1 4.04Å; L523-I559 HydrophobicContact CD1-CD1 4.4Å; L523-D697 HydrophobicContact CD1-CB 4.07Å; L523-D697 HydrophobicContact CD2-CB 4.23Å; L523-I698 HydrophobicContact CD2-CD1 4.13Å; L523-L701 HydrophobicContact CD2-CB 4.09Å; L523-L701 HydrophobicContact CD2-CD2 3.78Å; L523-L701 HydrophobicContact CD2-CG 4.41Å; L523-A983 HydrophobicContact CD2-CB 4.39Å; L523-A983 HydrophobicContact CG-CB 4.38Å
524	C	95.4	Very high	89.1	Confident	15 Å²	15	41.5 Å²	41.5	10%	0.101	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-37.9	174	-173.2	0	0	0	0	111.9	V520 S528 A983	V520-C524 WeakPolarHBondContact O-CB 3.24Å; V520-C524 PolarHBondContact O-N 2.83Å; C524-S528 WeakPolarHBondContact O-CB 3.4Å; C524-S528 PolarHBondContact O-N 2.96Å; C524-S528 PolarHBondContact O-OG 3.29Å; C524-A983 HydrophobicContact CB-CB 4.07Å
525	F	94.1	Very high	88.1	Confident	25 Å²	25	41.5 Å²	41.5	11%	0.11	25%	0.245	C	C	.	.	H	α-helix	trans	-65.5	-43.8	173.8	171.6	-91.5	0	0	0	112.1	L408 L409 H411 V414 Q521 G522 L523 F530 K536	L408-F525 WeakPolarHBondContact O-CZ 3.36Å; L409-F525 HydrophobicContact CD2-CE1 4.36Å; H411-F525 HydrophobicContact CB-CD1 3.93Å; H411-F525 HydrophobicContact CB-CD2 4.19Å; H411-F525 HydrophobicContact CB-CE1 3.54Å; H411-F525 HydrophobicContact CB-CE2 3.82Å; H411-F525 HydrophobicContact CB-CG 4.24Å; H411-F525 HydrophobicContact CB-CZ 3.49Å; H411-F525 VanDerWaalsContact CB-CZ 3.49Å; H411-F525 AromaticContact CD2-CD2 3.58Å; H411-F525 AromaticContact CD2-CE2 3.75Å; H411-F525 AromaticContact CE1-CG 3.84Å; H411-F525 AromaticContact CG-CD1 3.9Å; H411-F525 AromaticContact CG-CD2 3.7Å; H411-F525 AromaticContact CG-CE1 4Å; H411-F525 AromaticContact CG-CE2 3.8Å; H411-F525 AromaticContact CG-CG 3.75Å; H411-F525 AromaticContact CG-CZ 3.95Å; H411-F525 AromaticContact ND1-CD1 3.83Å; H411-F525 AromaticContact ND1-CD2 3.99Å; H411-F525 AromaticContact ND1-CG 3.62Å; H411-F525 AromaticContact NE2-CD2 3.84Å; V414-F525 HydrophobicContact CG2-CD1 3.72Å; V414-F525 HydrophobicContact CG2-CE1 3.91Å; Q521-F525 WeakPolarHBondContact O-CB 3.43Å; Q521-F525 PolarHBondContact O-N 2.71Å; G522-F525 WeakPolarHBondContact O-CB 3.37Å; G522-F525 PolarHBondContact O-N 2.97Å; L523-F525 VanDerWaalsContact C-N 3.28Å; L523-F525 PolarHBondContact O-N 3.5Å; F525-F530 AromaticContact CD2-CE2 3.69Å; F525-F530 HydrophobicContact CD2-CE2 3.69Å; F525-F530 HydrophobicContact CD2-CZ 4.15Å; F525-F530 HydrophobicContact CE2-CD2 4.49Å; F525-F530 AromaticContact CE2-CE2 3.65Å; F525-F530 HydrophobicContact CE2-CE2 3.65Å; F525-F530 HydrophobicContact CE2-CZ 4.49Å; F525-K536 HydrophobicContact CE1-CD 3.91Å; F525-K536 HydrophobicContact CE2-CD 4.06Å; F525-K536 HydrophobicContact CZ-CD 3.61Å; F525-K536 WeakPolarHBondContact O-CE 3.49Å; F525-K536 PolarHBondContact O-NZ 2.88Å
526	L	94.7	Very high	87.7	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-49.7	175.4	-68.6	176.9	0	0	0	111.3	L409 V414 G522 L523 S528 K536 L539 I559	L409-L526 HydrophobicContact CD2-CD2 4.35Å; V414-L526 HydrophobicContact CG2-CD2 4Å; V414-L526 HydrophobicContact CG2-CG 4.34Å; G522-L526 PolarHBondContact O-N 3.31Å; L523-L526 PolarHBondContact O-N 2.88Å; L526-S528 VanDerWaalsContact C-N 3.33Å; L526-S528 PolarHBondContact O-N 2.9Å; L526-K536 PolarHBondContact O-NZ 2.81Å; L526-L539 CarbonylContact C-O 3.5Å; L526-L539 PolarHBondContact O-N 2.77Å; L526-I559 HydrophobicContact CD1-CB 4.37Å; L526-I559 HydrophobicContact CD1-CD1 4.01Å; L526-I559 HydrophobicContact CD1-CG2 4.08Å
527	H	95.5	Very high	87.4	Confident	19 Å²	19	41.4 Å²	41.4	9%	0.088	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-24.4	-177.5	-78.9	-162.3	0	0	0	115	L523 A538 L539 Q694 D697	L523-H527 WeakPolarHBondContact O-CB 3.31Å; L523-H527 PolarHBondContact O-N 3.04Å; H527-A538 VanDerWaalsContact O-CB 3.24Å; H527-A538 WeakPolarHBondContact O-CB 3.44Å; H527-L539 PolarHBondContact CD2-O 3.17Å; H527-L539 VanDerWaalsContact CD2-O 3.31Å; H527-Q694 VanDerWaalsContact CB-NE2 3.32Å; H527-Q694 PolarHBondContact CE1-O 3.01Å; H527-Q694 PolarHBondContact O-NE2 3.3Å; H527-D697 IonicContact CD2-OD2 3.4Å; H527-D697 IonicContact CE1-OD2 3.51Å; H527-D697 IonicContact NE2-OD2 2.72Å; H527-D697 PolarHBondContact NE2-OD2 2.91Å
528	S	92	Very high	87.3	Confident	39 Å²	39	40.6 Å²	40.6	27%	0.273	24%	0.241	S	C	.	.			trans	-79.1	143.9	-179.6	-60.1	0	0	0	0	111.8	C524 L526 K536	C524-S528 WeakPolarHBondContact O-CB 3.4Å; C524-S528 PolarHBondContact O-N 2.96Å; C524-S528 PolarHBondContact O-OG 3.29Å; L526-S528 VanDerWaalsContact C-N 3.33Å; L526-S528 PolarHBondContact O-N 2.9Å; S528-K536 WeakPolarHBondContact O-CE 3.5Å; S528-K536 PolarHBondContact O-NZ 3.05Å
529	E	89.3	Confident	87.3	Confident	117 Å²	117	40.7 Å²	40.7	55%	0.547	24%	0.241	S	C	.	.			trans	-94.5	135.6	163.4	-178.5	165	-149.4	0	0	110.1	K536 A538	E529-K536 CarbonylContact C-O 3.59Å; E529-K536 WeakPolarHBondContact CA-O 3.28Å; E529-A538 HydrophobicContact CB-CB 4.28Å
530	F	85.4	Confident	87.2	Confident	96 Å²	96	40.7 Å²	40.7	42%	0.421	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-113	109.4	171.9	-58.7	-51.7	0	0	0	109.1	F525 G535 K536	F525-F530 AromaticContact CD2-CE2 3.69Å; F525-F530 HydrophobicContact CD2-CE2 3.69Å; F525-F530 HydrophobicContact CD2-CZ 4.15Å; F525-F530 HydrophobicContact CE2-CD2 4.49Å; F525-F530 AromaticContact CE2-CE2 3.65Å; F525-F530 HydrophobicContact CE2-CE2 3.65Å; F525-F530 HydrophobicContact CE2-CZ 4.49Å; F530-G535 CarbonylContact O-C 3.55Å; F530-G535 WeakPolarHBondContact O-CA 3.4Å; F530-K536 HydrophobicContact CB-CB 4.14Å; F530-K536 HydrophobicContact CD2-CB 3.79Å; F530-K536 HydrophobicContact CD2-CD 3.79Å; F530-K536 VanDerWaalsContact CD2-CE 3.43Å; F530-K536 HydrophobicContact CD2-CG 4.41Å; F530-K536 HydrophobicContact CE2-CD 3.95Å; F530-K536 VanDerWaalsContact CE2-CE 3.41Å; F530-K536 HydrophobicContact CG-CB 4.43Å; F530-K536 PolarHBondContact N-O 3.1Å; F530-K536 PolarHBondContact O-N 2.75Å
531	A	77.2	Confident	87.2	Confident	106 Å²	106	40.6 Å²	40.6	88%	0.876	24%	0.241	S	C	*	.			trans	-66.3	143.6	176.8	0	0	0	0	0	111.7
532	G	69.1	Low	87.2	Confident	56 Å²	56	38.6 Å²	38.6	58%	0.577	23%	0.231	S	C	*	.	S	Bend	trans	162.8	170.7	177.5	0	0	0	0	0	111.8	R534 G535	G532-R534 PolarHBondContact O-N 3Å; G532-G535 PolarHBondContact O-N 2.77Å
533	T	63.5	Low	87.1	Confident	155 Å²	155	39.2 Å²	39.2	95%	0.951	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-29.9	174.3	47.8	0	0	0	0	112.6
534	R	66	Low	87	Confident	131 Å²	131	39.3 Å²	39.3	49%	0.494	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	41.2	170.2	-56.4	177.5	-173.1	174	-4.2	110.9	D23 L408 G532	D23-R534 IonicContact OD1-CZ 3.59Å; D23-R534 IonicContact OD1-NE 3.41Å; D23-R534 PolarHBondContact OD1-NE 2.94Å; D23-R534 IonicContact OD1-NH2 3.55Å; D23-R534 PolarHBondContact OD1-NH2 3.38Å; D23-R534 WeakPolarHBondContact OD2-CD 2.97Å; D23-R534 IonicContact OD2-CZ 2.93Å; D23-R534 IonicContact OD2-NE 2.71Å; D23-R534 PolarHBondContact OD2-NE 3.49Å; D23-R534 IonicContact OD2-NH1 2.69Å; D23-R534 PolarHBondContact OD2-NH1 2.91Å; D23-R534 IonicContact OD2-NH2 3.48Å; D23-R534 PolarHBondContact OD2-NH2 2.96Å; L408-R534 HydrophobicContact CD1-CB 4.38Å; L408-R534 WeakPolarHBondContact CD1-O 3.5Å; L408-R534 WeakPolarHBondContact CG-O 3.21Å; G532-R534 PolarHBondContact O-N 3Å
535	G	70.5	Confident	86.9	Confident	28 Å²	28	39.7 Å²	39.7	29%	0.289	24%	0.235	S	C	.	.			trans	-58	142.3	-173	0	0	0	0	0	113.6	F530 G532	F530-G535 CarbonylContact O-C 3.55Å; F530-G535 WeakPolarHBondContact O-CA 3.4Å; G532-G535 PolarHBondContact O-N 2.77Å
536	K	86.7	Confident	86.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-86.4	114.7	173.1	-166.7	-156.4	72	75.1	0	108.2	V407 L408 L409 F525 L526 S528 E529 F530	V407-K536 HydrophobicContact CG1-CB 4.25Å; V407-K536 HydrophobicContact CG1-CG 3.39Å; L408-K536 HydrophobicContact CB-CB 4.34Å; L409-K536 HydrophobicContact CD2-CD 4.07Å; L409-K536 HydrophobicContact CD2-CG 4.15Å; F525-K536 HydrophobicContact CE1-CD 3.91Å; F525-K536 HydrophobicContact CE2-CD 4.06Å; F525-K536 HydrophobicContact CZ-CD 3.61Å; F525-K536 WeakPolarHBondContact O-CE 3.49Å; F525-K536 PolarHBondContact O-NZ 2.88Å; L526-K536 PolarHBondContact O-NZ 2.81Å; S528-K536 WeakPolarHBondContact O-CE 3.5Å; S528-K536 PolarHBondContact O-NZ 3.05Å; E529-K536 CarbonylContact C-O 3.59Å; E529-K536 WeakPolarHBondContact CA-O 3.28Å; F530-K536 HydrophobicContact CB-CB 4.14Å; F530-K536 HydrophobicContact CD2-CB 3.79Å; F530-K536 HydrophobicContact CD2-CD 3.79Å; F530-K536 VanDerWaalsContact CD2-CE 3.43Å; F530-K536 HydrophobicContact CD2-CG 4.41Å; F530-K536 HydrophobicContact CE2-CD 3.95Å; F530-K536 VanDerWaalsContact CE2-CE 3.41Å; F530-K536 HydrophobicContact CG-CB 4.43Å; F530-K536 PolarHBondContact N-O 3.1Å; F530-K536 PolarHBondContact O-N 2.75Å
537	P	86.7	Confident	86.6	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.006	24%	0.244	C	C	.	.			trans	-62.4	160.2	171.2	32.6	-42.3	0	0	0	111.9	V407 L539 R567	V407-P537 HydrophobicContact CG1-CG 4.14Å; V407-P537 HydrophobicContact CG2-CG 3.96Å; P537-L539 HydrophobicContact CG-CD2 4.25Å; P537-R567 HydrophobicContact CB-CG 3.62Å; P537-R567 VanDerWaalsContact CB-NE 3.27Å; P537-R567 HydrophobicContact CG-CG 3.91Å
538	A	92.5	Very high	86.5	Confident	6 Å²	6	40 Å²	40	5%	0.05	24%	0.241	C	C	.	.			trans	-64	135.9	158.9	0	0	0	0	0	110.6	H527 E529 L568 F690	H527-A538 VanDerWaalsContact O-CB 3.24Å; H527-A538 WeakPolarHBondContact O-CB 3.44Å; E529-A538 HydrophobicContact CB-CB 4.28Å; A538-L568 PolarHBondContact O-N 3.39Å; A538-F690 HydrophobicContact CB-CE1 3.48Å; A538-F690 VanDerWaalsContact CB-CE1 3.48Å; A538-F690 HydrophobicContact CB-CZ 3.51Å
539	L	94	Very high	86.7	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.3	173.4	-62.1	179.6	0	0	0	109.6	L403 L409 L526 H527 P537 V566 R567	L403-L539 HydrophobicContact CD2-CD1 4.12Å; L403-L539 HydrophobicContact CD2-CD2 4Å; L409-L539 HydrophobicContact CD1-CD1 3.83Å; L409-L539 HydrophobicContact CD2-CD1 3.72Å; L409-L539 HydrophobicContact CG-CD1 4.39Å; L526-L539 CarbonylContact C-O 3.5Å; L526-L539 PolarHBondContact O-N 2.77Å; H527-L539 PolarHBondContact CD2-O 3.17Å; H527-L539 VanDerWaalsContact CD2-O 3.31Å; P537-L539 HydrophobicContact CG-CD2 4.25Å; L539-V566 CarbonylContact C-O 3.52Å; L539-V566 VanDerWaalsContact CA-O 3.31Å; L539-V566 WeakPolarHBondContact CA-O 3.39Å; L539-R567 HydrophobicContact CD2-CB 3.88Å; L539-R567 HydrophobicContact CD2-CG 4.14Å
540	A	95.2	Very high	87	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.008	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.6	169.1	0	0	0	0	0	109.1	S565 V566 F690 Q694 D697	A540-S565 CarbonylContact O-C 3.44Å; A540-S565 WeakPolarHBondContact O-CA 3.1Å; A540-S565 VanDerWaalsContact O-CB 3.23Å; A540-S565 WeakPolarHBondContact O-CB 3.46Å; A540-V566 HydrophobicContact CB-CG2 4.02Å; A540-V566 PolarHBondContact N-O 3.25Å; A540-V566 PolarHBondContact O-N 3.09Å; A540-F690 HydrophobicContact CB-CD2 4.49Å; A540-F690 HydrophobicContact CB-CE2 3.83Å; A540-F690 HydrophobicContact CB-CZ 4.27Å; A540-Q694 HydrophobicContact CB-CG 4.04Å; A540-D697 VanDerWaalsContact CA-OD2 3.27Å; A540-D697 WeakPolarHBondContact CA-OD2 3.46Å
541	H	95.5	Very high	87.3	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.184	C	C	.	.			trans	-75.5	-42.5	-163.6	-165.7	-96	0	0	0	113.7	D543 L544 G560 S565 D697	H541-D543 PolarHBondContact CE1-O 3.1Å; H541-D543 VanDerWaalsContact CE1-O 3.29Å; H541-D543 PolarHBondContact ND1-O 3.08Å; H541-D543 PolarHBondContact O-N 3.44Å; H541-L544 HydrophobicContact CB-CB 4.47Å; H541-L544 PolarHBondContact ND1-N 2.86Å; H541-G560 PolarHBondContact CE1-O 3.12Å; H541-G560 PolarHBondContact NE2-O 3.11Å; H541-S565 WeakPolarHBondContact CA-OG 3.47Å; H541-S565 PolarHBondContact O-OG 2.8Å; H541-D697 WeakPolarHBondContact CB-OD1 3.38Å; H541-D697 VanDerWaalsContact N-CG 3.33Å; H541-D697 PolarHBondContact N-OD1 3.15Å; H541-D697 PolarHBondContact N-OD2 3.36Å
542	R	94.5	Very high	87.8	Confident	14 Å²	14	25.6 Å²	25.6	5%	0.053	15%	0.151	C	C	.	.	S	Bend	trans	68	-19.8	179.3	-58	178.6	61.6	-140	5.2	117.4	L564 V566 I665 G667 I670 Y693 D697	R542-L564 PolarHBondContact NH1-O 3.47Å; R542-V566 HydrophobicContact CG-CG2 4.27Å; R542-I665 PolarHBondContact NH1-O 3.02Å; R542-G667 PolarHBondContact NH2-O 3.28Å; R542-I670 VanDerWaalsContact NH2-CG2 3.27Å; R542-Y693 HydrophobicContact CG-CD1 3.82Å; R542-Y693 HydrophobicContact CG-CE1 4.44Å; R542-Y693 HydrophobicContact CG-CG 4.32Å; R542-D697 PolarHBondContact N-OD1 3.49Å
543	D	94.3	Very high	88.5	Confident	12 Å²	12	26 Å²	26	6%	0.064	15%	0.145	C	C	.	.			trans	-132.4	50.3	174.7	-171	40.4	0	0	0	111	H541 K545 N548 L564 G671 T672	H541-D543 PolarHBondContact CE1-O 3.1Å; H541-D543 VanDerWaalsContact CE1-O 3.29Å; H541-D543 PolarHBondContact ND1-O 3.08Å; H541-D543 PolarHBondContact O-N 3.44Å; D543-K545 IonicContact OD1-NZ 2.77Å; D543-K545 PolarHBondContact OD1-NZ 2.82Å; D543-K545 WeakPolarHBondContact OD2-CE 3.35Å; D543-K545 IonicContact OD2-NZ 3.05Å; D543-K545 PolarHBondContact OD2-NZ 2.65Å; D543-N548 PolarHBondContact O-ND2 3.08Å; D543-N548 PolarHBondContact OD2-ND2 3.26Å; D543-L564 HydrophobicContact CB-CD1 3.81Å; D543-G671 WeakPolarHBondContact OD1-CA 3.03Å; D543-T672 PolarHBondContact OD1-N 2.98Å
544	L	95.2	Very high	89.4	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	12%	0.115	C	C	.	.			trans	-78	122.1	178.6	-169.1	71.8	0	0	0	109.8	L523 H541 I549 I559 A700 L701 I704	L523-L544 HydrophobicContact CD1-CD2 4.26Å; L523-L544 HydrophobicContact CD2-CD2 4.16Å; H541-L544 HydrophobicContact CB-CB 4.47Å; H541-L544 PolarHBondContact ND1-N 2.86Å; L544-I549 HydrophobicContact CD1-CD1 4.38Å; L544-I549 HydrophobicContact CD1-CG1 4.41Å; L544-I559 HydrophobicContact CD1-CD1 4.14Å; L544-I559 HydrophobicContact CD1-CG1 4.34Å; L544-I559 HydrophobicContact CD1-CG2 3.92Å; L544-A700 HydrophobicContact CB-CB 4.03Å; L544-L701 HydrophobicContact CD2-CB 4.01Å; L544-I704 HydrophobicContact CD2-CD1 4.18Å; L544-I704 HydrophobicContact CG-CD1 3.8Å
545	K	92.8	Very high	90.5	Very high	23 Å²	23	17.4 Å²	17.4	10%	0.1	10%	0.099	C	C	.	.	S	Bend	trans	-164.3	163.7	-177.3	63.9	-166.1	-179	-151.1	0	111	D543 S547 N548 I549 T672 Y675	D543-K545 IonicContact OD1-NZ 2.77Å; D543-K545 PolarHBondContact OD1-NZ 2.82Å; D543-K545 WeakPolarHBondContact OD2-CE 3.35Å; D543-K545 IonicContact OD2-NZ 3.05Å; D543-K545 PolarHBondContact OD2-NZ 2.65Å; K545-S547 VanDerWaalsContact C-N 3.27Å; K545-S547 WeakPolarHBondContact CE-OG 3.32Å; K545-S547 WeakPolarHBondContact CG-OG 3.11Å; K545-S547 PolarHBondContact O-N 2.86Å; K545-S547 VanDerWaalsContact O-N 3.15Å; K545-N548 WeakPolarHBondContact CE-ND2 3.47Å; K545-N548 WeakPolarHBondContact CE-OD1 3.24Å; K545-N548 HydrophobicContact CG-CB 4.14Å; K545-N548 PolarHBondContact O-N 3.48Å; K545-I549 PolarHBondContact O-N 2.99Å; K545-T672 HydrophobicContact CD-CG2 4.45Å; K545-T672 WeakPolarHBondContact CD-OG1 3.16Å; K545-T672 PolarHBondContact NZ-OG1 3.06Å; K545-Y675 HydrophobicContact CB-CD1 4.42Å; K545-Y675 HydrophobicContact CB-CD2 3.55Å; K545-Y675 HydrophobicContact CB-CE2 3.68Å; K545-Y675 HydrophobicContact CB-CG 3.97Å
546	P	92.1	Very high	91.5	Very high	5 Å²	5	16 Å²	16	3%	0.032	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-60	-27.3	-175.6	-26.3	36.3	0	0	0	115.3	L462 K463 N548 Y675 I704	L462-P546 HydrophobicContact CB-CB 4.21Å; L462-P546 WeakPolarHBondContact CB-O 3.4Å; L462-P546 HydrophobicContact CD2-CB 4.44Å; L462-P546 HydrophobicContact CG-CB 4.27Å; L462-P546 PolarHBondContact N-O 3.45Å; L462-P546 VanDerWaalsContact N-O 3.14Å; K463-P546 HydrophobicContact CB-CB 4Å; K463-P546 PolarHBondContact N-O 2.93Å; P546-N548 VanDerWaalsContact C-N 3.28Å; P546-N548 PolarHBondContact O-N 3.09Å; P546-Y675 WeakPolarHBondContact CD-OH 3.13Å; P546-Y675 HydrophobicContact CG-CE1 4.39Å; P546-Y675 WeakPolarHBondContact CG-OH 3.41Å; P546-I704 HydrophobicContact CG-CG1 4.19Å
547	S	90.3	Very high	91.8	Very high	39 Å²	39	16 Å²	16	27%	0.273	9%	0.086	S	C	.	.	G	3₁₀ helix	trans	-73.9	-17.6	175.3	69.3	0	0	0	0	114.2	T461 K545	T461-S547 VanDerWaalsContact CG2-O 3.27Å; T461-S547 WeakPolarHBondContact CG2-O 3.39Å; K545-S547 VanDerWaalsContact C-N 3.27Å; K545-S547 WeakPolarHBondContact CE-OG 3.32Å; K545-S547 WeakPolarHBondContact CG-OG 3.11Å; K545-S547 PolarHBondContact O-N 2.86Å; K545-S547 VanDerWaalsContact O-N 3.15Å
548	N	93.9	Very high	92.2	Very high	7 Å²	7	16 Å²	16	4%	0.037	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-103.2	7.2	-178.6	-63.6	10.8	0	0	0	111	D543 K545 P546 G560 D561	D543-N548 PolarHBondContact O-ND2 3.08Å; D543-N548 PolarHBondContact OD2-ND2 3.26Å; K545-N548 WeakPolarHBondContact CE-ND2 3.47Å; K545-N548 WeakPolarHBondContact CE-OD1 3.24Å; K545-N548 HydrophobicContact CG-CB 4.14Å; K545-N548 PolarHBondContact O-N 3.48Å; P546-N548 VanDerWaalsContact C-N 3.28Å; P546-N548 PolarHBondContact O-N 3.09Å; N548-G560 PolarHBondContact O-N 2.99Å; N548-D561 HydrophobicContact CB-CB 4.46Å
549	I	96.1	Very high	92.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.9	174.3	-63.6	161.1	0	0	0	106.8	T461 L462 L519 L544 K545 C557 I704	T461-I549 CarbonylContact C-O 3.55Å; T461-I549 WeakPolarHBondContact CA-O 3.29Å; T461-I549 WeakPolarHBondContact CB-O 3.48Å; L462-I549 HydrophobicContact CB-CB 4.01Å; L462-I549 HydrophobicContact CB-CG2 3.99Å; L462-I549 HydrophobicContact CD2-CB 4.38Å; L462-I549 HydrophobicContact CD2-CD1 4.15Å; L462-I549 HydrophobicContact CD2-CG2 4.12Å; L462-I549 PolarHBondContact N-O 3.42Å; L519-I549 HydrophobicContact CD1-CD1 3.5Å; L519-I549 VanDerWaalsContact CD1-CD1 3.5Å; L519-I549 HydrophobicContact CD1-CG1 3.87Å; L519-I549 HydrophobicContact CD1-CG2 4.3Å; L519-I549 HydrophobicContact CD2-CD1 3.92Å; L519-I549 HydrophobicContact CG-CD1 4.38Å; L544-I549 HydrophobicContact CD1-CD1 4.38Å; L544-I549 HydrophobicContact CD1-CG1 4.41Å; K545-I549 PolarHBondContact O-N 2.99Å; I549-C557 HydrophobicContact CG2-CB 3.72Å; I549-I704 HydrophobicContact CD1-CD1 3.82Å; I549-I704 HydrophobicContact CD1-CG2 3.92Å
550	Y	94.7	Very high	92.4	Very high	12 Å²	12	15.7 Å²	15.7	5%	0.047	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	142	-179.4	-62	-85	0	0	0	111.2	K384 H415 C457 G460 T461 C557 C558	K384-Y550 WeakPolarHBondContact CE-OH 3.18Å; K384-Y550 PolarHBondContact NZ-OH 3.41Å; H415-Y550 HydrophobicContact CB-CD2 4.13Å; H415-Y550 HydrophobicContact CB-CE2 4.35Å; H415-Y550 AromaticContact CD2-CD2 3.92Å; H415-Y550 AromaticContact CG-CD2 3.86Å; H415-Y550 AromaticContact CG-CE2 3.92Å; H415-Y550 AromaticContact ND1-CE2 3.86Å; C457-Y550 VanDerWaalsContact SG-CB 3.57Å; G460-Y550 WeakPolarHBondContact O-CA 3.04Å; T461-Y550 HydrophobicContact CG2-CD1 4.01Å; T461-Y550 HydrophobicContact CG2-CE1 3.68Å; Y550-C557 CarbonylContact O-C 3.58Å; Y550-C557 WeakPolarHBondContact O-CA 3.35Å; Y550-C557 VanDerWaalsContact O-CB 3.25Å; Y550-C557 WeakPolarHBondContact O-CB 3.47Å; Y550-C558 PolarHBondContact N-O 2.76Å; Y550-C558 PolarHBondContact O-N 2.83Å
551	V	93.3	Very high	92.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	122.2	-178	-171.8	0	0	0	0	111.2	C457 A458 Y459 G460 L462 F465 C557	C457-V551 WeakPolarHBondContact CB-O 3.37Å; A458-V551 PolarHBondContact N-O 3.18Å; Y459-V551 HydrophobicContact CD2-CG1 4.18Å; Y459-V551 PolarHBondContact N-O 3.46Å; G460-V551 PolarHBondContact O-N 3.05Å; L462-V551 HydrophobicContact CB-CG2 4.08Å; L462-V551 HydrophobicContact CD1-CG2 3.85Å; F465-V551 HydrophobicContact CB-CG2 4.24Å; F465-V551 HydrophobicContact CD2-CB 3.76Å; F465-V551 HydrophobicContact CD2-CG1 3.62Å; F465-V551 HydrophobicContact CD2-CG2 3.88Å; F465-V551 HydrophobicContact CE2-CB 4.25Å; F465-V551 HydrophobicContact CE2-CG1 3.57Å; F465-V551 HydrophobicContact CG-CB 4.49Å; F465-V551 HydrophobicContact CG-CG2 4.13Å; V551-C557 HydrophobicContact CG2-CB 4.47Å
552	R	87.9	Confident	91.9	Very high	45 Å²	45	17.9 Å²	17.9	17%	0.17	10%	0.095	C	C	.	.			trans	-86.9	167.6	-174.5	-53.6	178	92.9	86.1	1.2	110.6	E455 Y459 D554 W555 S556 C558	E455-R552 VanDerWaalsContact CD-NH1 3.3Å; E455-R552 IonicContact OE1-CZ 3.91Å; E455-R552 IonicContact OE1-NH1 3.3Å; E455-R552 PolarHBondContact OE1-NH1 2.69Å; E455-R552 IonicContact OE1-NH2 3.87Å; E455-R552 IonicContact OE2-CZ 2.81Å; E455-R552 IonicContact OE2-NH1 3.51Å; E455-R552 PolarHBondContact OE2-NH1 3.17Å; E455-R552 IonicContact OE2-NH2 3.97Å; E455-R552 PolarHBondContact OE2-NH2 2.95Å; Y459-R552 WeakPolarHBondContact CD2-O 3.44Å; R552-D554 WeakPolarHBondContact CB-OD1 3.3Å; R552-D554 PolarHBondContact O-N 3.36Å; R552-D554 VanDerWaalsContact O-N 3.1Å; R552-W555 WeakPolarHBondContact O-CA 3.19Å; R552-W555 PolarHBondContact O-N 2.86Å; R552-S556 VanDerWaalsContact CB-O 3.31Å; R552-S556 WeakPolarHBondContact CB-O 3.42Å; R552-S556 WeakPolarHBondContact CG-O 3.42Å; R552-S556 PolarHBondContact N-O 2.87Å; R552-C558 PolarHBondContact NH1-SG 2.99Å
553	S	83.7	Confident	91.6	Very high	65 Å²	65	17.3 Å²	17.3	46%	0.455	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-3	-179.2	40.9	0	0	0	0	115.4	K119	K119-S553 WeakPolarHBondContact CE-OG 3.25Å; K119-S553 PolarHBondContact NZ-OG 3.38Å
554	D	81.8	Confident	91.5	Very high	60 Å²	60	17 Å²	17	32%	0.321	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	15.9	169.6	55.1	14	0	0	0	112.1	R552 S556	R552-D554 WeakPolarHBondContact CB-OD1 3.3Å; R552-D554 PolarHBondContact O-N 3.36Å; R552-D554 VanDerWaalsContact O-N 3.1Å; D554-S556 VanDerWaalsContact CG-OG 3.3Å; D554-S556 PolarHBondContact O-N 3.2Å; D554-S556 VanDerWaalsContact OD1-CB 3.29Å; D554-S556 WeakPolarHBondContact OD1-CB 3.38Å; D554-S556 PolarHBondContact OD1-N 3.05Å; D554-S556 PolarHBondContact OD1-OG 2.89Å
555	W	87.8	Confident	91.4	Very high	44 Å²	44	16.9 Å²	16.9	17%	0.167	9%	0.091	C	C	.	.	S	Bend	trans	60.2	2.2	-174	-46.1	-46.9	0	0	0	115.8	Y459 F475 I511 I515 R552	Y459-W555 AromaticContact CE2-CD1 3.57Å; Y459-W555 AromaticContact CE2-NE1 3.84Å; Y459-W555 AromaticContact CZ-CD1 3.96Å; Y459-W555 AromaticContact CZ-NE1 3.78Å; Y459-W555 PolarHBondContact OH-NE1 3Å; Y459-W555 VanDerWaalsContact OH-NE1 3.16Å; F475-W555 AromaticContact CZ-CZ2 3.93Å; F475-W555 HydrophobicContact CZ-CZ2 3.93Å; I511-W555 HydrophobicContact CD1-CD2 4.34Å; I511-W555 HydrophobicContact CD1-CG 4.45Å; I511-W555 HydrophobicContact CG1-CB 4.2Å; I511-W555 HydrophobicContact CG1-CD2 3.72Å; I511-W555 HydrophobicContact CG1-CE3 3.91Å; I511-W555 HydrophobicContact CG1-CG 3.83Å; I511-W555 HydrophobicContact CG2-CB 4.47Å; I515-W555 WeakPolarHBondContact CG1-O 3.37Å; R552-W555 WeakPolarHBondContact O-CA 3.19Å; R552-W555 PolarHBondContact O-N 2.86Å
556	S	91.7	Very high	91.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.			trans	-78.6	155.8	171.1	81.3	0	0	0	0	111.2	R413 E514 R552 D554	R413-S556 PolarHBondContact NH1-OG 3.18Å; E514-S556 WeakPolarHBondContact OE1-CB 3.48Å; R552-S556 VanDerWaalsContact CB-O 3.31Å; R552-S556 WeakPolarHBondContact CB-O 3.42Å; R552-S556 WeakPolarHBondContact CG-O 3.42Å; R552-S556 PolarHBondContact N-O 2.87Å; D554-S556 VanDerWaalsContact CG-OG 3.3Å; D554-S556 PolarHBondContact O-N 3.2Å; D554-S556 VanDerWaalsContact OD1-CB 3.29Å; D554-S556 WeakPolarHBondContact OD1-CB 3.38Å; D554-S556 PolarHBondContact OD1-N 3.05Å; D554-S556 PolarHBondContact OD1-OG 2.89Å
557	C	94.4	Very high	91.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	164.9	-176.8	80.9	0	0	0	0	113.8	R413 S518 L519 I549 Y550 V551	R413-C557 WeakPolarHBondContact CD-O 3.39Å; S518-C557 PolarHBondContact OG-N 3Å; S518-C557 PolarHBondContact OG-SG 2.79Å; S518-C557 VanDerWaalsContact OG-SG 3.4Å; L519-C557 WeakPolarHBondContact CA-SG 2.98Å; L519-C557 VanDerWaalsContact CB-SG 3.52Å; L519-C557 PolarHBondContact N-SG 2.95Å; I549-C557 HydrophobicContact CG2-CB 3.72Å; Y550-C557 CarbonylContact O-C 3.58Å; Y550-C557 WeakPolarHBondContact O-CA 3.35Å; Y550-C557 VanDerWaalsContact O-CB 3.25Å; Y550-C557 WeakPolarHBondContact O-CB 3.47Å; V551-C557 HydrophobicContact CG2-CB 4.47Å
558	C	95.1	Very high	91.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	141.9	173.7	55.6	0	0	0	0	111.8	R413 Y550 R552	R413-C558 VanDerWaalsContact C-CB 3.46Å; R413-C558 WeakPolarHBondContact O-CA 3.44Å; Y550-C558 PolarHBondContact N-O 2.76Å; Y550-C558 PolarHBondContact O-N 2.83Å; R552-C558 PolarHBondContact NH1-SG 2.99Å
559	I	96.8	Very high	90.8	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.6	-178.5	-55.3	173.4	0	0	0	110	R413 V414 H415 L519 L523 L526 L544	R413-I559 PolarHBondContact O-N 3.18Å; V414-I559 CarbonylContact C-O 3.59Å; V414-I559 WeakPolarHBondContact CA-O 3.21Å; H415-I559 PolarHBondContact N-O 2.92Å; L519-I559 HydrophobicContact CD1-CD1 4.07Å; L519-I559 HydrophobicContact CD1-CG1 3.87Å; L523-I559 HydrophobicContact CB-CD1 4.04Å; L523-I559 HydrophobicContact CD1-CD1 4.4Å; L526-I559 HydrophobicContact CD1-CB 4.37Å; L526-I559 HydrophobicContact CD1-CD1 4.01Å; L526-I559 HydrophobicContact CD1-CG2 4.08Å; L544-I559 HydrophobicContact CD1-CD1 4.14Å; L544-I559 HydrophobicContact CD1-CG1 4.34Å; L544-I559 HydrophobicContact CD1-CG2 3.92Å
560	G	92.8	Very high	90.1	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.01	12%	0.123	C	C	.	.			trans	-126.5	-176.8	173.5	0	0	0	0	0	113	H541 N548	H541-G560 PolarHBondContact CE1-O 3.12Å; H541-G560 PolarHBondContact NE2-O 3.11Å; N548-G560 PolarHBondContact O-N 2.99Å
561	D	90.3	Very high	89.4	Confident	46 Å²	46	28.5 Å²	28.5	25%	0.246	16%	0.157	C	C	.	.			trans	63	42.9	-175.8	-71.2	-26.5	0	0	0	116.3	K384 N548 G563	K384-D561 IonicContact NZ-OD1 2.76Å; K384-D561 PolarHBondContact NZ-OD1 3.4Å; K384-D561 IonicContact NZ-OD2 2.71Å; K384-D561 PolarHBondContact NZ-OD2 3.46Å; N548-D561 HydrophobicContact CB-CB 4.46Å; D561-G563 PolarHBondContact O-N 3.45Å
562	I	91.1	Very high	88.8	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-65.5	1.5	175.5	66.5	170.4	0	0	0	115.7	T400 L403 H404 L409 L564 S565	T400-I562 HydrophobicContact CG2-CG1 4.27Å; L403-I562 HydrophobicContact CB-CD1 3.63Å; L403-I562 HydrophobicContact CD1-CB 4.49Å; L403-I562 HydrophobicContact CD1-CD1 4.15Å; L403-I562 HydrophobicContact CD1-CG1 4.29Å; L403-I562 WeakPolarHBondContact CD1-O 3.19Å; H404-I562 WeakPolarHBondContact NE2-CD1 3.4Å; L409-I562 HydrophobicContact CD1-CD1 3.33Å; I562-L564 PolarHBondContact O-N 2.84Å; I562-S565 WeakPolarHBondContact CA-OG 3.41Å; I562-S565 WeakPolarHBondContact O-CB 3.07Å; I562-S565 PolarHBondContact O-N 3Å; I562-S565 PolarHBondContact O-OG 3.24Å; I562-S565 VanDerWaalsContact O-OG 3.08Å
563	G	88.4	Confident	88.6	Confident	2 Å²	2	34.1 Å²	34.1	2%	0.021	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-63.7	-24.2	-174.3	0	0	0	0	0	114.8	T400 D561	T400-G563 WeakPolarHBondContact OG1-CA 3.4Å; T400-G563 PolarHBondContact OG1-N 3.43Å; D561-G563 PolarHBondContact O-N 3.45Å
564	L	91.5	Very high	88.3	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.026	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-88.6	-9.8	173.2	-70.1	176.2	0	0	0	113.8	F368 I396 R542 D543 I562 I670	F368-L564 HydrophobicContact CE2-CD1 3.99Å; F368-L564 HydrophobicContact CZ-CD1 4.35Å; F368-L564 HydrophobicContact CZ-CD2 4.48Å; I396-L564 HydrophobicContact CD1-CD2 3.71Å; I396-L564 HydrophobicContact CD1-CG 4.42Å; I396-L564 HydrophobicContact CG1-CD2 3.96Å; R542-L564 PolarHBondContact NH1-O 3.47Å; D543-L564 HydrophobicContact CB-CD1 3.81Å; I562-L564 PolarHBondContact O-N 2.84Å; L564-I670 HydrophobicContact CD1-CG1 4.11Å; L564-I670 HydrophobicContact CD2-CD1 3.57Å; L564-I670 HydrophobicContact CD2-CG1 3.91Å; L564-I670 HydrophobicContact CD2-CG2 4.34Å
565	S	92.8	Very high	88.2	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-63.6	139.3	-173.3	-59.6	0	0	0	0	111.8	R399 A540 H541 I562	R399-S565 PolarHBondContact NH2-O 2.74Å; A540-S565 CarbonylContact O-C 3.44Å; A540-S565 WeakPolarHBondContact O-CA 3.1Å; A540-S565 VanDerWaalsContact O-CB 3.23Å; A540-S565 WeakPolarHBondContact O-CB 3.46Å; H541-S565 WeakPolarHBondContact CA-OG 3.47Å; H541-S565 PolarHBondContact O-OG 2.8Å; I562-S565 WeakPolarHBondContact CA-OG 3.41Å; I562-S565 WeakPolarHBondContact O-CB 3.07Å; I562-S565 PolarHBondContact O-N 3Å; I562-S565 PolarHBondContact O-OG 3.24Å; I562-S565 VanDerWaalsContact O-OG 3.08Å
566	V	92.8	Very high	88	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.012	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	146.7	174.9	-68.9	0	0	0	0	110.8	L539 A540 R542 E661 P664 F690 Y693	L539-V566 CarbonylContact C-O 3.52Å; L539-V566 VanDerWaalsContact CA-O 3.31Å; L539-V566 WeakPolarHBondContact CA-O 3.39Å; A540-V566 HydrophobicContact CB-CG2 4.02Å; A540-V566 PolarHBondContact N-O 3.25Å; A540-V566 PolarHBondContact O-N 3.09Å; R542-V566 HydrophobicContact CG-CG2 4.27Å; V566-E661 CarbonylContact C-O 3.51Å; V566-E661 WeakPolarHBondContact CA-O 3.28Å; V566-P664 HydrophobicContact CG1-CB 4.15Å; V566-F690 HydrophobicContact CG2-CD2 4.33Å; V566-F690 WeakPolarHBondContact O-CE2 3.47Å; V566-Y693 HydrophobicContact CG2-CD2 3.72Å; V566-Y693 HydrophobicContact CG2-CE2 4.34Å; V566-Y693 HydrophobicContact CG2-CG 3.86Å
567	R	90.6	Very high	87.6	Confident	76 Å²	76	35.5 Å²	35.5	29%	0.287	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	153.5	173.1	-170.9	175.3	171.7	144.1	8.2	111.3	P537 L539 E661 W662	P537-R567 HydrophobicContact CB-CG 3.62Å; P537-R567 VanDerWaalsContact CB-NE 3.27Å; P537-R567 HydrophobicContact CG-CG 3.91Å; L539-R567 HydrophobicContact CD2-CB 3.88Å; L539-R567 HydrophobicContact CD2-CG 4.14Å; R567-E661 HydrophobicContact CB-CB 3.84Å; R567-E661 WeakPolarHBondContact CD-OE2 3.4Å; R567-E661 IonicContact CZ-OE2 3.33Å; R567-E661 PolarHBondContact N-O 2.96Å; R567-E661 IonicContact NE-OE2 3.2Å; R567-E661 IonicContact NH1-OE2 3.61Å; R567-E661 PolarHBondContact NH1-OE2 2.81Å; R567-W662 HydrophobicContact CB-CB 4.37Å; R567-W662 WeakPolarHBondContact O-CA 3.27Å; R567-W662 WeakPolarHBondContact O-CB 3.47Å
568	L	87.3	Confident	87.2	Confident	67 Å²	67	40.9 Å²	40.9	35%	0.351	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-52.3	122.3	163.3	-176.8	73.3	0	0	0	109.8	A538 F690	A538-L568 PolarHBondContact O-N 3.39Å; L568-F690 HydrophobicContact CB-CD1 4.13Å; L568-F690 HydrophobicContact CB-CD2 4.4Å; L568-F690 HydrophobicContact CB-CE1 4.35Å; L568-F690 HydrophobicContact CB-CG 4.16Å; L568-F690 HydrophobicContact CD1-CB 3.84Å; L568-F690 HydrophobicContact CD1-CD1 3.57Å; L568-F690 HydrophobicContact CD1-CE1 4.39Å; L568-F690 HydrophobicContact CD1-CG 3.83Å; L568-F690 HydrophobicContact CG-CD1 4.47Å
569	P	85.1	Confident	86.7	Confident	13 Å²	13	46.3 Å²	46.3	8%	0.084	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-68.9	156.4	-179.4	27.2	-34.4	0	0	0	112.2	C571 F573 W662	P569-C571 PolarHBondContact O-N 3.48Å; P569-F573 HydrophobicContact CB-CD1 4.05Å; P569-F573 HydrophobicContact CB-CE1 3.38Å; P569-F573 HydrophobicContact CB-CZ 4.08Å; P569-F573 HydrophobicContact CG-CE1 3.55Å; P569-F573 HydrophobicContact CG-CZ 3.72Å; P569-W662 HydrophobicContact CB-CB 3.93Å; P569-W662 HydrophobicContact CB-CD2 4.01Å; P569-W662 HydrophobicContact CB-CE3 4.11Å; P569-W662 HydrophobicContact CB-CG 3.96Å
570	P	83.2	Confident	86.2	Confident	60 Å²	60	46.4 Å²	46.4	39%	0.39	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-63	137.8	175.7	28.2	-35.4	0	0	0	110.9	P572 F573	P570-P572 CarbonylContact C-O 3.55Å; P570-P572 CarbonylContact O-C 3.43Å; P570-P572 VanDerWaalsContact O-O 3.13Å; P570-F573 WeakPolarHBondContact O-CA 3.29Å; P570-F573 PolarHBondContact O-N 2.91Å
571	C	79.3	Confident	86	Confident	111 Å²	111	48.9 Å²	48.9	75%	0.75	27%	0.267	S	S	*	.	S	Bend	trans	-111.1	120.7	173.1	-71	0	0	0	0	109.8	P569	P569-C571 PolarHBondContact O-N 3.48Å
572	P	81.1	Confident	85.8	Confident	115 Å²	115	52.9 Å²	52.9	75%	0.747	28%	0.282	S	S	*	.	S	Bend	cis	-69.7	157.8	-5.7	32.2	-36.5	0	0	0	112.6	P570	P570-P572 CarbonylContact C-O 3.55Å; P570-P572 CarbonylContact O-C 3.43Å; P570-P572 VanDerWaalsContact O-O 3.13Å
573	F	82.6	Confident	85.6	Confident	49 Å²	49	53.6 Å²	53.6	22%	0.215	29%	0.286	C	S	.	.			trans	-58.3	154.1	171.7	-74.6	-77.1	0	0	0	111.8	P569 P570 F575 V577 L580 F688	P569-F573 HydrophobicContact CB-CD1 4.05Å; P569-F573 HydrophobicContact CB-CE1 3.38Å; P569-F573 HydrophobicContact CB-CZ 4.08Å; P569-F573 HydrophobicContact CG-CE1 3.55Å; P569-F573 HydrophobicContact CG-CZ 3.72Å; P570-F573 WeakPolarHBondContact O-CA 3.29Å; P570-F573 PolarHBondContact O-N 2.91Å; F573-F575 VanDerWaalsContact CB-O 3.23Å; F573-F575 WeakPolarHBondContact CB-O 3.48Å; F573-F575 PolarHBondContact O-N 3.36Å; F573-V577 HydrophobicContact CD2-CG2 4.05Å; F573-V577 HydrophobicContact CE2-CG2 4.19Å; F573-L580 HydrophobicContact CB-CD1 3.93Å; F573-L580 HydrophobicContact CD1-CD1 3.44Å; F573-L580 VanDerWaalsContact CD1-CD1 3.44Å; F573-L580 HydrophobicContact CD2-CD1 4.47Å; F573-L580 HydrophobicContact CE1-CD1 3.99Å; F573-L580 HydrophobicContact CG-CD1 3.72Å; F573-F688 HydrophobicContact CE1-CB 4.04Å; F573-F688 HydrophobicContact CE1-CD1 4.5Å; F573-F688 HydrophobicContact CZ-CB 3.85Å
574	P	76.9	Confident	85.6	Confident	35 Å²	35	54 Å²	54	23%	0.227	29%	0.287	C	S	.	.	S	Bend	trans	-67.2	-15.6	175.4	29	-36.2	0	0	0	113.8	M296 W662	M296-P574 HydrophobicContact CE-CB 4.31Å; M296-P574 HydrophobicContact SD-CB 4.38Å; P574-W662 HydrophobicContact CG-CH2 4.05Å; P574-W662 HydrophobicContact CG-CZ2 3.85Å
575	F	80.7	Confident	85.4	Confident	47 Å²	47	59 Å²	59	21%	0.206	31%	0.31	C	S	.	.	S	Bend	trans	-139.2	163.5	-179.9	-63.8	-62	0	0	0	110.1	F573 R579 L580 L648 W652	F573-F575 VanDerWaalsContact CB-O 3.23Å; F573-F575 WeakPolarHBondContact CB-O 3.48Å; F573-F575 PolarHBondContact O-N 3.36Å; F575-R579 HydrophobicContact CB-CB 4.3Å; F575-L580 HydrophobicContact CB-CD2 4.03Å; F575-L580 HydrophobicContact CB-CG 4Å; F575-L580 HydrophobicContact CD2-CD2 3.85Å; F575-L580 HydrophobicContact CG-CD2 4.43Å; F575-L648 HydrophobicContact CD1-CD2 4.38Å; F575-L648 HydrophobicContact CE1-CD2 3.68Å; F575-L648 HydrophobicContact CE2-CD2 4.38Å; F575-L648 HydrophobicContact CZ-CD2 3.66Å; F575-W652 HydrophobicContact CE2-CD2 4.34Å; F575-W652 AromaticContact CE2-CE2 3.98Å; F575-W652 HydrophobicContact CE2-CG 4.35Å; F575-W652 HydrophobicContact CE2-CZ2 4.48Å; F575-W652 AromaticContact CE2-NE1 3.81Å; F575-W652 AromaticContact CZ-CD1 3.56Å; F575-W652 AromaticContact CZ-CE2 3.99Å; F575-W652 HydrophobicContact CZ-CG 4.29Å; F575-W652 AromaticContact CZ-NE1 3.36Å
576	S	83.2	Confident	85	Confident	55 Å²	55	63 Å²	63	39%	0.385	33%	0.326	S	S	.	.			trans	-61.9	149.2	167.2	62.8	0	0	0	0	110.5	D578 R579 L580	S576-D578 PolarHBondContact O-N 2.99Å; S576-R579 PolarHBondContact O-N 2.88Å; S576-R579 WeakPolarHBondContact OG-CD 3.46Å; S576-R579 WeakPolarHBondContact OG-CG 3.34Å; S576-L580 PolarHBondContact O-N 3.3Å
577	V	84.3	Confident	84.6	Confident	60 Å²	60	63 Å²	63	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-58.3	-37.1	-176.3	176.8	0	0	0	0	111.1	F573 R579 L580 H581	F573-V577 HydrophobicContact CD2-CG2 4.05Å; F573-V577 HydrophobicContact CE2-CG2 4.19Å; V577-R579 PolarHBondContact O-N 3.24Å; V577-L580 WeakPolarHBondContact O-CB 3.44Å; V577-L580 PolarHBondContact O-N 2.85Å; V577-H581 WeakPolarHBondContact CG1-CE1 3.33Å; V577-H581 WeakPolarHBondContact CG1-ND1 3.46Å; V577-H581 PolarHBondContact O-N 2.9Å; V577-H581 PolarHBondContact O-ND1 3.45Å
578	D	84.9	Confident	84.3	Confident	113 Å²	113	60.4 Å²	60.4	60%	0.604	32%	0.319	S	S	*	.	H	α-helix	trans	-66.4	-37.6	178.2	-35.3	-65.7	0	0	0	112.3	S576 H581 K582	S576-D578 PolarHBondContact O-N 2.99Å; D578-H581 PolarHBondContact O-N 3.05Å; D578-K582 WeakPolarHBondContact O-CG 3.24Å; D578-K582 PolarHBondContact O-N 2.99Å
579	R	84.8	Confident	83.9	Confident	114 Å²	114	62.2 Å²	62.2	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-68.3	-38.2	175.7	-76	176.8	172.3	175.6	-2.8	111.1	F575 S576 V577 L583	F575-R579 HydrophobicContact CB-CB 4.3Å; S576-R579 PolarHBondContact O-N 2.88Å; S576-R579 WeakPolarHBondContact OG-CD 3.46Å; S576-R579 WeakPolarHBondContact OG-CG 3.34Å; V577-R579 PolarHBondContact O-N 3.24Å; R579-L583 WeakPolarHBondContact O-CB 3.4Å; R579-L583 PolarHBondContact O-N 2.78Å
580	L	87.1	Confident	83.4	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-62.7	-43.6	173.1	-70.7	177.3	0	0	0	111.8	F573 F575 S576 V577 L583 Y584 W662 F688	F573-L580 HydrophobicContact CB-CD1 3.93Å; F573-L580 HydrophobicContact CD1-CD1 3.44Å; F573-L580 VanDerWaalsContact CD1-CD1 3.44Å; F573-L580 HydrophobicContact CD2-CD1 4.47Å; F573-L580 HydrophobicContact CE1-CD1 3.99Å; F573-L580 HydrophobicContact CG-CD1 3.72Å; F575-L580 HydrophobicContact CB-CD2 4.03Å; F575-L580 HydrophobicContact CB-CG 4Å; F575-L580 HydrophobicContact CD2-CD2 3.85Å; F575-L580 HydrophobicContact CG-CD2 4.43Å; S576-L580 PolarHBondContact O-N 3.3Å; V577-L580 WeakPolarHBondContact O-CB 3.44Å; V577-L580 PolarHBondContact O-N 2.85Å; L580-L583 PolarHBondContact O-N 3.49Å; L580-Y584 WeakPolarHBondContact O-CB 3.46Å; L580-Y584 PolarHBondContact O-N 3.14Å; L580-W662 HydrophobicContact CD2-CH2 4.07Å; L580-W662 HydrophobicContact CD2-CZ3 4.39Å; L580-F688 HydrophobicContact CB-CD2 4Å; L580-F688 HydrophobicContact CB-CE1 4.2Å; L580-F688 HydrophobicContact CB-CE2 3.52Å; L580-F688 HydrophobicContact CB-CZ 3.63Å; L580-F688 HydrophobicContact CD1-CD1 4.35Å; L580-F688 HydrophobicContact CD1-CE1 4.49Å; L580-F688 HydrophobicContact CD1-CG 4.42Å
581	H	88.6	Confident	82.8	Confident	54 Å²	54	63.3 Å²	63.3	25%	0.25	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-46.5	177.1	-76.6	87.2	0	0	0	112.5	V577 D578 L583 Y584 Q585 N686 F688	V577-H581 WeakPolarHBondContact CG1-CE1 3.33Å; V577-H581 WeakPolarHBondContact CG1-ND1 3.46Å; V577-H581 PolarHBondContact O-N 2.9Å; V577-H581 PolarHBondContact O-ND1 3.45Å; D578-H581 PolarHBondContact O-N 3.05Å; H581-L583 VanDerWaalsContact C-N 3.29Å; H581-L583 PolarHBondContact O-N 3.22Å; H581-Y584 PolarHBondContact O-N 2.89Å; H581-Q585 WeakPolarHBondContact O-CG 3.5Å; H581-Q585 PolarHBondContact O-N 2.83Å; H581-N686 PolarHBondContact NE2-OD1 3.03Å; H581-F688 AromaticContact CE1-CD2 3.72Å; H581-F688 AromaticContact ND1-CD2 3.95Å
582	K	86.7	Confident	82.2	Confident	129 Å²	129	61.8 Å²	61.8	56%	0.561	31%	0.307	S	S	*	.	H	α-helix	trans	-59	-40.6	175.5	-72.2	-179	-179.4	-172.9	0	112.1	D578 Y586	D578-K582 WeakPolarHBondContact O-CG 3.24Å; D578-K582 PolarHBondContact O-N 2.99Å; K582-Y586 PolarHBondContact O-N 3.37Å
583	L	86.5	Confident	81	Confident	17 Å²	17	63.7 Å²	63.7	9%	0.089	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-40	177.1	-156.7	157.7	0	0	0	111.2	R579 L580 H581 Y586 Y587 L657 W663	R579-L583 WeakPolarHBondContact O-CB 3.4Å; R579-L583 PolarHBondContact O-N 2.78Å; L580-L583 PolarHBondContact O-N 3.49Å; H581-L583 VanDerWaalsContact C-N 3.29Å; H581-L583 PolarHBondContact O-N 3.22Å; L583-Y586 PolarHBondContact O-N 3.45Å; L583-Y587 PolarHBondContact O-N 3.34Å; L583-L657 HydrophobicContact CD1-CD1 4.46Å; L583-L657 HydrophobicContact CD2-CD1 3.28Å; L583-L657 HydrophobicContact CD2-CD2 4.02Å; L583-L657 HydrophobicContact CD2-CG 4.28Å; L583-L657 HydrophobicContact CG-CD1 4.47Å; L583-W663 HydrophobicContact CD2-CH2 3.6Å; L583-W663 HydrophobicContact CD2-CZ2 4.09Å; L583-W663 HydrophobicContact CD2-CZ3 4.46Å
584	Y	88.4	Confident	79.5	Confident	10 Å²	10	67.7 Å²	67.7	4%	0.039	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-39.9	177.2	-172.5	-110.2	0	0	0	113.1	L580 H581 Y587 T588 W663 P664 G667 I668 P687 F688	L580-Y584 WeakPolarHBondContact O-CB 3.46Å; L580-Y584 PolarHBondContact O-N 3.14Å; H581-Y584 PolarHBondContact O-N 2.89Å; Y584-Y587 HydrophobicContact CD2-CD1 4.06Å; Y584-Y587 AromaticContact CE2-CD1 3.9Å; Y584-Y587 HydrophobicContact CE2-CD1 3.9Å; Y584-Y587 HydrophobicContact CE2-CE1 4.37Å; Y584-Y587 CarbonylContact O-C 3.6Å; Y584-Y587 WeakPolarHBondContact O-CB 3.33Å; Y584-Y587 PolarHBondContact O-N 2.9Å; Y584-T588 HydrophobicContact CD1-CG2 4.07Å; Y584-T588 HydrophobicContact CE1-CG2 3.6Å; Y584-T588 HydrophobicContact CE2-CG2 4.11Å; Y584-T588 PolarHBondContact O-N 3.1Å; Y584-T588 PolarHBondContact O-OG1 2.83Å; Y584-W663 HydrophobicContact CD2-CH2 4Å; Y584-W663 AromaticContact CD2-CZ2 3.64Å; Y584-W663 HydrophobicContact CD2-CZ2 3.64Å; Y584-W663 HydrophobicContact CE2-CZ2 4.49Å; Y584-P664 HydrophobicContact CD2-CG 4.38Å; Y584-P664 HydrophobicContact CE2-CG 3.62Å; Y584-G667 VanDerWaalsContact OH-CA 3.25Å; Y584-G667 WeakPolarHBondContact OH-CA 3.29Å; Y584-I668 HydrophobicContact CE1-CD1 4.31Å; Y584-I668 HydrophobicContact CE1-CG1 4.19Å; Y584-I668 PolarHBondContact OH-N 2.95Å; Y584-I668 VanDerWaalsContact OH-N 3.1Å; Y584-P687 HydrophobicContact CD1-CB 3.78Å; Y584-P687 HydrophobicContact CD1-CG 3.58Å; Y584-P687 HydrophobicContact CE1-CB 3.54Å; Y584-P687 HydrophobicContact CE1-CG 3.8Å; Y584-P687 HydrophobicContact CE2-CB 4.4Å; Y584-P687 HydrophobicContact CG-CB 4.26Å; Y584-P687 HydrophobicContact CG-CG 4.17Å; Y584-F688 HydrophobicContact CG-CZ 4.33Å
585	Q	86.6	Confident	78.1	Confident	111 Å²	111	68.9 Å²	68.9	52%	0.519	32%	0.322	S	S	.	.	H	α-helix	trans	-57.8	-49.5	172.6	-73.6	167.6	-25.9	0	0	110.8	H581 Y587 T588 D589	H581-Q585 WeakPolarHBondContact O-CG 3.5Å; H581-Q585 PolarHBondContact O-N 2.83Å; Q585-Y587 VanDerWaalsContact C-N 3.27Å; Q585-Y587 PolarHBondContact O-N 3.27Å; Q585-T588 WeakPolarHBondContact CA-OG1 3.27Å; Q585-T588 PolarHBondContact O-N 2.66Å; Q585-T588 VanDerWaalsContact O-N 3.13Å; Q585-T588 PolarHBondContact O-OG1 3.05Å; Q585-D589 WeakPolarHBondContact O-CB 3.34Å; Q585-D589 PolarHBondContact O-N 3.22Å
586	Y	84.4	Confident	76.2	Confident	83 Å²	83	71.6 Å²	71.6	33%	0.325	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-37.5	175.4	-175.8	-104.8	0	0	0	113	K582 L583 Y590 L621 L649 F654	K582-Y586 PolarHBondContact O-N 3.37Å; L583-Y586 PolarHBondContact O-N 3.45Å; Y586-Y590 WeakPolarHBondContact O-CB 3.33Å; Y586-Y590 PolarHBondContact O-N 2.61Å; Y586-L621 WeakPolarHBondContact OH-CD2 3.4Å; Y586-L649 HydrophobicContact CD1-CD2 3.96Å; Y586-L649 HydrophobicContact CE1-CD1 4.25Å; Y586-L649 HydrophobicContact CE1-CD2 3.75Å; Y586-F654 AromaticContact CD1-CE1 3.82Å; Y586-F654 HydrophobicContact CD1-CE1 3.82Å; Y586-F654 AromaticContact CD1-CZ 3.52Å; Y586-F654 HydrophobicContact CD1-CZ 3.52Å; Y586-F654 HydrophobicContact CE1-CE1 4.07Å; Y586-F654 HydrophobicContact CE1-CE2 4.21Å; Y586-F654 AromaticContact CE1-CZ 3.43Å; Y586-F654 HydrophobicContact CE1-CZ 3.43Å; Y586-F654 VanDerWaalsContact CE1-CZ 3.43Å
587	Y	85.6	Confident	73.8	Confident	1 Å²	1	74.2 Å²	74.2	0%	0.004	35%	0.345	C	S	.	.	H	α-helix	trans	-65.6	-47.4	172.9	173.7	-107.1	0	0	0	112.5	L583 Y584 Q585 Y590 T591 F654 E658 W663 G666	L583-Y587 PolarHBondContact O-N 3.34Å; Y584-Y587 HydrophobicContact CD2-CD1 4.06Å; Y584-Y587 AromaticContact CE2-CD1 3.9Å; Y584-Y587 HydrophobicContact CE2-CD1 3.9Å; Y584-Y587 HydrophobicContact CE2-CE1 4.37Å; Y584-Y587 CarbonylContact O-C 3.6Å; Y584-Y587 WeakPolarHBondContact O-CB 3.33Å; Y584-Y587 PolarHBondContact O-N 2.9Å; Q585-Y587 VanDerWaalsContact C-N 3.27Å; Q585-Y587 PolarHBondContact O-N 3.27Å; Y587-Y590 PolarHBondContact O-N 3.1Å; Y587-T591 HydrophobicContact CD2-CG2 4.12Å; Y587-T591 HydrophobicContact CE1-CG2 4.15Å; Y587-T591 HydrophobicContact CE2-CG2 3.64Å; Y587-T591 WeakPolarHBondContact O-CG2 3.43Å; Y587-T591 PolarHBondContact O-N 3.35Å; Y587-T591 PolarHBondContact O-OG1 3.29Å; Y587-F654 AromaticContact CD2-CD1 3.67Å; Y587-F654 HydrophobicContact CD2-CD1 3.67Å; Y587-F654 AromaticContact CD2-CE1 3.84Å; Y587-F654 HydrophobicContact CD2-CE1 3.84Å; Y587-F654 HydrophobicContact CD2-CG 4.19Å; Y587-F654 HydrophobicContact CD2-CZ 4.48Å; Y587-F654 HydrophobicContact CG-CD1 4.49Å; Y587-F654 HydrophobicContact CG-CE1 4.36Å; Y587-E658 HydrophobicContact CE2-CG 3.81Å; Y587-E658 VanDerWaalsContact CE2-OE1 3.23Å; Y587-E658 WeakPolarHBondContact CE2-OE1 3.31Å; Y587-E658 PolarHBondContact OH-OE1 2.83Å; Y587-W663 HydrophobicContact CD1-CZ2 4.04Å; Y587-W663 AromaticContact CD1-NE1 3.56Å; Y587-W663 AromaticContact CE1-NE1 3.5Å; Y587-W663 AromaticContact CG-CZ2 3.97Å; Y587-W663 HydrophobicContact CG-CZ2 3.97Å; Y587-W663 AromaticContact CG-NE1 3.94Å; Y587-W663 AromaticContact CZ-NE1 3.84Å; Y587-G666 PolarHBondContact OH-N 3.42Å
588	T	83.1	Confident	71.4	Confident	23 Å²	23	78.1 Å²	78.1	14%	0.141	36%	0.357	C	S	.	.	H	α-helix	trans	-63	-46.6	-179.5	48.1	0	0	0	0	111.4	Y584 Q585 Y590 T591 E592	Y584-T588 HydrophobicContact CD1-CG2 4.07Å; Y584-T588 HydrophobicContact CE1-CG2 3.6Å; Y584-T588 HydrophobicContact CE2-CG2 4.11Å; Y584-T588 PolarHBondContact O-N 3.1Å; Y584-T588 PolarHBondContact O-OG1 2.83Å; Q585-T588 WeakPolarHBondContact CA-OG1 3.27Å; Q585-T588 PolarHBondContact O-N 2.66Å; Q585-T588 VanDerWaalsContact O-N 3.13Å; Q585-T588 PolarHBondContact O-OG1 3.05Å; T588-Y590 VanDerWaalsContact C-N 3.28Å; T588-Y590 PolarHBondContact O-N 2.6Å; T588-T591 WeakPolarHBondContact CA-OG1 3.36Å; T588-T591 PolarHBondContact O-N 2.68Å; T588-T591 PolarHBondContact O-OG1 2.8Å; T588-E592 PolarHBondContact O-N 2.96Å
589	D	79.4	Confident	68.9	Low	105 Å²	105	77.2 Å²	77.2	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-39.1	-179.2	-61.7	-7.9	0	0	0	111.4	Q585 K593	Q585-D589 WeakPolarHBondContact O-CB 3.34Å; Q585-D589 PolarHBondContact O-N 3.22Å; D589-K593 PolarHBondContact O-N 3.34Å
590	Y	74.8	Confident	66.2	Low	84 Å²	84	81.1 Å²	81.1	33%	0.329	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-50.1	172.2	-174.4	-90.3	0	0	0	111.3	Y586 Y587 T588 E592 K593 Y594 F654	Y586-Y590 WeakPolarHBondContact O-CB 3.33Å; Y586-Y590 PolarHBondContact O-N 2.61Å; Y587-Y590 PolarHBondContact O-N 3.1Å; T588-Y590 VanDerWaalsContact C-N 3.28Å; T588-Y590 PolarHBondContact O-N 2.6Å; Y590-E592 PolarHBondContact O-N 3.48Å; Y590-K593 PolarHBondContact O-N 3.05Å; Y590-Y594 HydrophobicContact CD1-CD2 4.1Å; Y590-Y594 HydrophobicContact CD1-CE2 4.31Å; Y590-Y594 HydrophobicContact CD2-CD2 4.44Å; Y590-Y594 HydrophobicContact CD2-CE2 4.03Å; Y590-Y594 AromaticContact CE1-CD2 3.8Å; Y590-Y594 HydrophobicContact CE1-CD2 3.8Å; Y590-Y594 AromaticContact CE1-CE2 3.75Å; Y590-Y594 HydrophobicContact CE1-CE2 3.75Å; Y590-Y594 HydrophobicContact CE2-CD2 4.17Å; Y590-Y594 AromaticContact CE2-CE2 3.43Å; Y590-Y594 HydrophobicContact CE2-CE2 3.43Å; Y590-Y594 VanDerWaalsContact CE2-CE2 3.43Å; Y590-Y594 HydrophobicContact CG-CD2 4.41Å; Y590-Y594 HydrophobicContact CG-CE2 4.43Å; Y590-Y594 AromaticContact CZ-CD2 3.84Å; Y590-Y594 AromaticContact CZ-CE2 3.26Å; Y590-Y594 AromaticContact CZ-CZ 3.77Å; Y590-Y594 WeakPolarHBondContact O-CD2 3.35Å; Y590-Y594 PolarHBondContact O-N 3.15Å; Y590-Y594 WeakPolarHBondContact OH-CE2 3.38Å; Y590-Y594 PolarHBondContact OH-OH 2.83Å; Y590-F654 HydrophobicContact CD1-CD2 4.05Å; Y590-F654 AromaticContact CD1-CE2 3.56Å; Y590-F654 HydrophobicContact CD1-CE2 3.56Å; Y590-F654 HydrophobicContact CD1-CZ 4.38Å; Y590-F654 AromaticContact CD2-CE2 3.88Å; Y590-F654 HydrophobicContact CD2-CE2 3.88Å; Y590-F654 HydrophobicContact CE1-CD2 4.14Å; Y590-F654 AromaticContact CE1-CE2 3.98Å; Y590-F654 HydrophobicContact CE1-CE2 3.98Å; Y590-F654 HydrophobicContact CE2-CE2 4.27Å; Y590-F654 HydrophobicContact CG-CD2 4.43Å; Y590-F654 AromaticContact CG-CE2 3.51Å; Y590-F654 HydrophobicContact CG-CE2 3.51Å; Y590-F654 HydrophobicContact CG-CZ 4.07Å
591	T	70.4	Confident	63.4	Low	11 Å²	11	85.4 Å²	85.4	7%	0.067	39%	0.394	C	S	.	.	H	α-helix	trans	-64.7	-38.8	-178.2	56.7	0	0	0	0	113.7	I392 Y587 T588 K593 Y594 L595	I392-T591 HydrophobicContact CD1-CG2 4.45Å; Y587-T591 HydrophobicContact CD2-CG2 4.12Å; Y587-T591 HydrophobicContact CE1-CG2 4.15Å; Y587-T591 HydrophobicContact CE2-CG2 3.64Å; Y587-T591 WeakPolarHBondContact O-CG2 3.43Å; Y587-T591 PolarHBondContact O-N 3.35Å; Y587-T591 PolarHBondContact O-OG1 3.29Å; T588-T591 WeakPolarHBondContact CA-OG1 3.36Å; T588-T591 PolarHBondContact O-N 2.68Å; T588-T591 PolarHBondContact O-OG1 2.8Å; T591-K593 VanDerWaalsContact C-N 3.34Å; T591-K593 PolarHBondContact O-N 2.81Å; T591-Y594 PolarHBondContact O-N 2.84Å; T591-L595 WeakPolarHBondContact O-CB 3.38Å; T591-L595 VanDerWaalsContact O-CG 3.26Å; T591-L595 WeakPolarHBondContact O-CG 3.49Å; T591-L595 PolarHBondContact O-N 3.48Å
592	E	66.2	Low	60.8	Low	80 Å²	80	87.1 Å²	87.1	37%	0.374	41%	0.412	S	S	.	.	H	α-helix	trans	-61.8	-43.5	177.5	-72.9	-172.8	179.8	0	0	110.6	T588 Y590 Y594 L595 H596 K683	T588-E592 PolarHBondContact O-N 2.96Å; Y590-E592 PolarHBondContact O-N 3.48Å; E592-Y594 PolarHBondContact O-N 3.38Å; E592-L595 PolarHBondContact O-N 2.84Å; E592-H596 PolarHBondContact O-CD2 3.07Å; E592-H596 VanDerWaalsContact O-CD2 3.26Å; E592-H596 PolarHBondContact O-N 3.33Å; E592-K683 IonicContact OE1-NZ 3.68Å; E592-K683 PolarHBondContact OE1-NZ 2.88Å; E592-K683 IonicContact OE2-NZ 2.71Å
593	K	55.9	Low	58.3	Low	154 Å²	154	89 Å²	89	67%	0.67	42%	0.423	S	S	*	.	H	α-helix	trans	-59.7	-41.4	177.7	-168.5	171.9	-174.7	172.1	0	113.1	D589 Y590 T591 L597	D589-K593 PolarHBondContact O-N 3.34Å; Y590-K593 PolarHBondContact O-N 3.05Å; T591-K593 VanDerWaalsContact C-N 3.34Å; T591-K593 PolarHBondContact O-N 2.81Å; K593-L597 PolarHBondContact O-N 3.18Å
594	Y	51.4	Low	55.8	Low	133 Å²	133	95.4 Å²	95.4	52%	0.522	46%	0.457	S	S	.	.	H	α-helix	trans	-78.1	-27	178.1	-82.4	-96.3	0	0	0	113.8	Y590 T591 E592	Y590-Y594 HydrophobicContact CD1-CD2 4.1Å; Y590-Y594 HydrophobicContact CD1-CE2 4.31Å; Y590-Y594 HydrophobicContact CD2-CD2 4.44Å; Y590-Y594 HydrophobicContact CD2-CE2 4.03Å; Y590-Y594 AromaticContact CE1-CD2 3.8Å; Y590-Y594 HydrophobicContact CE1-CD2 3.8Å; Y590-Y594 AromaticContact CE1-CE2 3.75Å; Y590-Y594 HydrophobicContact CE1-CE2 3.75Å; Y590-Y594 HydrophobicContact CE2-CD2 4.17Å; Y590-Y594 AromaticContact CE2-CE2 3.43Å; Y590-Y594 HydrophobicContact CE2-CE2 3.43Å; Y590-Y594 VanDerWaalsContact CE2-CE2 3.43Å; Y590-Y594 HydrophobicContact CG-CD2 4.41Å; Y590-Y594 HydrophobicContact CG-CE2 4.43Å; Y590-Y594 AromaticContact CZ-CD2 3.84Å; Y590-Y594 AromaticContact CZ-CE2 3.26Å; Y590-Y594 AromaticContact CZ-CZ 3.77Å; Y590-Y594 WeakPolarHBondContact O-CD2 3.35Å; Y590-Y594 PolarHBondContact O-N 3.15Å; Y590-Y594 WeakPolarHBondContact OH-CE2 3.38Å; Y590-Y594 PolarHBondContact OH-OH 2.83Å; T591-Y594 PolarHBondContact O-N 2.84Å; E592-Y594 PolarHBondContact O-N 3.38Å
595	L	47.4	Very low	53.2	Low	61 Å²	61	99.1 Å²	99.1	32%	0.319	48%	0.477	S	S	.	.	H	α-helix	trans	-71.9	-40.9	173.9	-74.4	167	0	0	0	111.6	T591 E592 L597 K598	T591-L595 WeakPolarHBondContact O-CB 3.38Å; T591-L595 VanDerWaalsContact O-CG 3.26Å; T591-L595 WeakPolarHBondContact O-CG 3.49Å; T591-L595 PolarHBondContact O-N 3.48Å; E592-L595 PolarHBondContact O-N 2.84Å; L595-L597 PolarHBondContact O-N 2.83Å; L595-K598 PolarHBondContact O-N 2.8Å
596	H	40.8	Very low	50.6	Low	104 Å²	104	100.7 Å²	100.7	48%	0.481	48%	0.483	S	S	.	.	H	α-helix	trans	-69.2	-28.2	178.6	-82.4	-70.8	0	0	0	114.1	E592 K598 N599	E592-H596 PolarHBondContact O-CD2 3.07Å; E592-H596 VanDerWaalsContact O-CD2 3.26Å; E592-H596 PolarHBondContact O-N 3.33Å; H596-K598 PolarHBondContact O-N 3.37Å; H596-K598 VanDerWaalsContact O-N 3.13Å; H596-N599 PolarHBondContact O-N 3.09Å; H596-N599 VanDerWaalsContact O-N 3.11Å
597	L	31.7	Very low	48.1	Very low	110 Å²	110	102 Å²	102	58%	0.576	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-60.4	-20.3	176.9	-87.3	161.7	0	0	0	114	K593 L595	K593-L597 PolarHBondContact O-N 3.18Å; L595-L597 PolarHBondContact O-N 2.83Å
598	K	34.8	Very low	45.6	Very low	142 Å²	142	106.8 Å²	106.8	62%	0.617	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-81	-8.4	176.6	-74	-163.7	173.6	-165.2	0	115.1	L595 H596	L595-K598 PolarHBondContact O-N 2.8Å; H596-K598 PolarHBondContact O-N 3.37Å; H596-K598 VanDerWaalsContact O-N 3.13Å
599	N	32.7	Very low	43.1	Very low	93 Å²	93	111.1 Å²	111.1	50%	0.497	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-90.5	-5.1	179	-72.8	9.5	0	0	0	113.5	H596 T601	H596-N599 PolarHBondContact O-N 3.09Å; H596-N599 VanDerWaalsContact O-N 3.11Å; N599-T601 PolarHBondContact O-N 3.26Å
600	Y	27.4	Very low	40.7	Very low	197 Å²	197	114.5 Å²	114.5	77%	0.773	56%	0.558	S	S	*	*	S	Bend	trans	-82.4	111.9	165	-81.5	-88.1	0	0	0	109.2
601	T	29.7	Very low	38.5	Very low	92 Å²	92	115.9 Å²	115.9	56%	0.564	58%	0.575	S	S	*	*			trans	-61.7	143.2	171.2	45.7	0	0	0	0	110.4	N599 E603	N599-T601 PolarHBondContact O-N 3.26Å; T601-E603 PolarHBondContact O-N 3.32Å
602	S	32.2	Very low	36.3	Very low	90 Å²	90	121.6 Å²	121.6	63%	0.629	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	9	-171.3	-172.4	0	0	0	0	115.2
603	E	35.9	Very low	34.5	Very low	168 Å²	168	125.1 Å²	125.1	79%	0.785	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-18.3	-167.5	-64.2	178.6	138	0	0	113.7	T601	T601-E603 PolarHBondContact O-N 3.32Å
604	N	32.5	Very low	33	Very low	151 Å²	151	124.8 Å²	124.8	81%	0.807	62%	0.624	S	S	*	*	S	Bend	trans	-106.3	7.3	-176.6	-75	-47.2	0	0	0	115
605	L	34.5	Very low	31.9	Very low	88 Å²	88	122.1 Å²	122.1	46%	0.461	62%	0.623	S	S	.	*	S	Bend	trans	-92.8	129.8	179	-79.7	156.4	0	0	0	111.4	E609	L605-E609 HydrophobicContact CD2-CB 4Å
606	K	31.1	Very low	30.9	Very low	145 Å²	145	125.6 Å²	125.6	63%	0.63	64%	0.636	S	S	*	*			trans	-62.3	150.4	176.2	-75.2	-179.3	178.3	176.2	0	110.3	S608 E609	K606-S608 PolarHBondContact O-N 3.5Å; K606-E609 PolarHBondContact O-N 3.43Å
607	P	33.6	Very low	30.2	Very low	109 Å²	109	127.9 Å²	127.9	71%	0.708	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-54.5	-29.5	178.5	-27.2	35.3	0	0	0	114.2	E609 R610	P607-E609 VanDerWaalsContact C-N 3.27Å; P607-E609 PolarHBondContact O-N 2.82Å; P607-R610 PolarHBondContact O-N 3.49Å
608	S	31.7	Very low	30	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-71.2	-12.7	176.3	55.8	0	0	0	0	115.2	K606	K606-S608 PolarHBondContact O-N 3.5Å
609	E	31.2	Very low	29.7	Very low	115 Å²	115	127.3 Å²	127.3	54%	0.537	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-105.1	2	179.2	-66	175.2	141	0	0	112.3	L605 K606 P607 V611	L605-E609 HydrophobicContact CD2-CB 4Å; K606-E609 PolarHBondContact O-N 3.43Å; P607-E609 VanDerWaalsContact C-N 3.27Å; P607-E609 PolarHBondContact O-N 2.82Å; E609-V611 PolarHBondContact O-N 3.38Å
610	R	29.1	Very low	29.5	Very low	175 Å²	175	127.7 Å²	127.7	66%	0.66	66%	0.664	S	S	*	*			trans	-74.1	72.5	164.9	-63.2	-173.7	-171.2	-168.5	2.6	109.9	P607 D612	P607-R610 PolarHBondContact O-N 3.49Å; R610-D612 PolarHBondContact O-N 2.89Å
611	V	28.1	Very low	29.7	Very low	114 Å²	114	121.9 Å²	121.9	69%	0.691	65%	0.646	S	S	*	*			trans	-69	125.6	161.5	179.8	0	0	0	0	107.1	E609 I613	E609-V611 PolarHBondContact O-N 3.38Å; V611-I613 WeakPolarHBondContact O-CG1 3.24Å; V611-I613 PolarHBondContact O-N 3.3Å
612	D	25.5	Very low	29.8	Very low	131 Å²	131	120.9 Å²	120.9	70%	0.701	64%	0.637	S	S	*	*			trans	-63	98.2	172.3	-69.7	-51.7	0	0	0	109.6	R610 F614	R610-D612 PolarHBondContact O-N 2.89Å; D612-F614 HydrophobicContact CB-CD2 3.89Å; D612-F614 HydrophobicContact CB-CE2 3.86Å; D612-F614 PolarHBondContact O-N 3.35Å
613	I	26.7	Very low	29.9	Very low	154 Å²	154	121.4 Å²	121.4	79%	0.79	64%	0.637	S	S	*	*			trans	-74.9	77.2	179.2	-52.9	178.9	0	0	0	109	V611 P615	V611-I613 WeakPolarHBondContact O-CG1 3.24Å; V611-I613 PolarHBondContact O-N 3.3Å; I613-P615 VanDerWaalsContact O-CD 3.3Å; I613-P615 WeakPolarHBondContact O-CD 3.33Å
614	F	25.8	Very low	29.8	Very low	146 Å²	146	116.9 Å²	116.9	64%	0.64	62%	0.62	S	S	*	*			trans	-71.5	111.8	161.3	-78.3	-84.1	0	0	0	108.6	D612 F616	D612-F614 HydrophobicContact CB-CD2 3.89Å; D612-F614 HydrophobicContact CB-CE2 3.86Å; D612-F614 PolarHBondContact O-N 3.35Å; F614-F616 PolarHBondContact O-N 2.82Å
615	P	26.6	Very low	30	Very low	77 Å²	77	116.7 Å²	116.7	50%	0.5	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	42.6	-169.3	35.9	-36	0	0	0	112.6	I613	I613-P615 VanDerWaalsContact O-CD 3.3Å; I613-P615 WeakPolarHBondContact O-CD 3.33Å
616	F	27.5	Very low	30.1	Very low	135 Å²	135	114.8 Å²	114.8	59%	0.592	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.7	-1.3	-171.7	-75.6	-71.6	0	0	0	116.9	F614 S618	F614-F616 PolarHBondContact O-N 2.82Å; F616-S618 PolarHBondContact O-N 2.71Å
617	E	25.3	Very low	30.1	Very low	152 Å²	152	111.6 Å²	111.6	71%	0.71	59%	0.592	S	S	*	*			trans	-74.5	115.4	166.9	-77.3	-155.4	155.7	0	0	111.2	Q619	E617-Q619 HydrophobicContact CB-CG 4.34Å; E617-Q619 PolarHBondContact O-N 2.69Å; E617-Q619 PolarHBondContact OE2-NE2 2.92Å; E617-Q619 VanDerWaalsContact OE2-NE2 3.13Å
618	S	27.6	Very low	30	Very low	98 Å²	98	112.4 Å²	112.4	69%	0.685	59%	0.59	S	S	*	*			trans	-70.7	65.1	166.9	61.5	0	0	0	0	110.7	F616 S620	F616-S618 PolarHBondContact O-N 2.71Å; S618-S620 VanDerWaalsContact C-N 3.33Å; S618-S620 PolarHBondContact O-N 2.77Å
619	Q	28.7	Very low	30	Very low	142 Å²	142	113.5 Å²	113.5	66%	0.664	59%	0.587	S	S	*	*			trans	-66.5	100.7	162.6	-67.2	-173.4	8.7	0	0	106.9	E617 L621	E617-Q619 HydrophobicContact CB-CG 4.34Å; E617-Q619 PolarHBondContact O-N 2.69Å; E617-Q619 PolarHBondContact OE2-NE2 2.92Å; E617-Q619 VanDerWaalsContact OE2-NE2 3.13Å; Q619-L621 PolarHBondContact O-N 3.1Å
620	S	29.3	Very low	30.1	Very low	101 Å²	101	114.7 Å²	114.7	71%	0.706	59%	0.59	S	S	*	*			trans	-38.4	136.2	162.9	49.1	0	0	0	0	109.3	S618 D622	S618-S620 VanDerWaalsContact C-N 3.33Å; S618-S620 PolarHBondContact O-N 2.77Å; S620-D622 WeakPolarHBondContact O-CA 3.32Å; S620-D622 PolarHBondContact O-N 3.43Å
621	L	31.3	Very low	30.1	Very low	74 Å²	74	113.9 Å²	113.9	39%	0.387	59%	0.594	S	S	.	*			trans	-40.5	107.7	179.9	-101.7	80.8	0	0	0	109.4	Y586 Q619 T623 I626 L649	Y586-L621 WeakPolarHBondContact OH-CD2 3.4Å; Q619-L621 PolarHBondContact O-N 3.1Å; L621-T623 PolarHBondContact O-N 3.26Å; L621-I626 HydrophobicContact CB-CD1 4.25Å; L621-I626 HydrophobicContact CD2-CD1 4.07Å; L621-L649 HydrophobicContact CD2-CD1 3.94Å
622	D	32.2	Very low	30.2	Very low	72 Å²	72	114.1 Å²	114.1	39%	0.385	60%	0.596	S	S	.	*			trans	-62.5	110.3	-169.2	-173.1	-5.2	0	0	0	107.7	S620 T624 K625	S620-D622 WeakPolarHBondContact O-CA 3.32Å; S620-D622 PolarHBondContact O-N 3.43Å; D622-T624 PolarHBondContact O-N 2.96Å; D622-T624 PolarHBondContact OD1-OG1 3.07Å; D622-T624 PolarHBondContact OD2-OG1 3.31Å; D622-T624 VanDerWaalsContact OD2-OG1 3.1Å; D622-K625 PolarHBondContact O-N 3.2Å
623	T	34.5	Very low	30.5	Very low	101 Å²	101	113.5 Å²	113.5	62%	0.62	60%	0.597	S	S	*	*	H	α-helix	trans	-59.7	-18.7	-169	34	0	0	0	0	112.2	L621 N627	L621-T623 PolarHBondContact O-N 3.26Å; T623-N627 PolarHBondContact O-N 2.88Å; T623-N627 PolarHBondContact O-ND2 3.36Å
624	T	32.6	Very low	30.5	Very low	72 Å²	72	118.2 Å²	118.2	44%	0.442	61%	0.605	S	S	.	*	H	α-helix	trans	-63	-39.9	170.1	61.7	0	0	0	0	113.3	D622 N627 L628	D622-T624 PolarHBondContact O-N 2.96Å; D622-T624 PolarHBondContact OD1-OG1 3.07Å; D622-T624 PolarHBondContact OD2-OG1 3.31Å; D622-T624 VanDerWaalsContact OD2-OG1 3.1Å; T624-N627 WeakPolarHBondContact O-CB 2.92Å; T624-N627 PolarHBondContact O-N 2.78Å; T624-N627 VanDerWaalsContact O-N 3.14Å; T624-L628 PolarHBondContact O-N 3.15Å; T624-L628 VanDerWaalsContact O-N 3.07Å
625	K	37.1	Very low	30.6	Very low	147 Å²	147	114 Å²	114	64%	0.639	60%	0.602	S	S	*	*	H	α-helix	trans	-76.5	-26.8	178.1	-74.8	171.3	-178.8	154.5	0	112.9	D622 N627	D622-K625 PolarHBondContact O-N 3.2Å; K625-N627 VanDerWaalsContact C-N 3.25Å
626	I	36	Very low	30.9	Very low	49 Å²	49	118.3 Å²	118.3	25%	0.251	62%	0.622	S	S	.	*	H	α-helix	trans	-67.5	-30.2	167.1	-59.9	178.8	0	0	0	110.4	L621	L621-I626 HydrophobicContact CB-CD1 4.25Å; L621-I626 HydrophobicContact CD2-CD1 4.07Å
627	N	31	Very low	30.9	Very low	78 Å²	78	121.5 Å²	121.5	42%	0.417	64%	0.638	S	S	.	*	H	α-helix	trans	-76.8	-34.7	175.5	-69.1	-27.5	0	0	0	113.5	T623 T624 K625 L629 K630	T623-N627 PolarHBondContact O-N 2.88Å; T623-N627 PolarHBondContact O-ND2 3.36Å; T624-N627 WeakPolarHBondContact O-CB 2.92Å; T624-N627 PolarHBondContact O-N 2.78Å; T624-N627 VanDerWaalsContact O-N 3.14Å; K625-N627 VanDerWaalsContact C-N 3.25Å; N627-L629 PolarHBondContact O-N 3.43Å; N627-K630 VanDerWaalsContact O-CB 3.27Å; N627-K630 WeakPolarHBondContact O-CB 3.38Å; N627-K630 PolarHBondContact O-N 2.91Å; N627-K630 WeakPolarHBondContact OD1-CE 3.26Å; N627-K630 PolarHBondContact OD1-NZ 3.25Å
628	L	33	Very low	31.2	Very low	126 Å²	126	119.7 Å²	119.7	66%	0.66	64%	0.643	S	S	*	*	H	α-helix	trans	-62.5	-25	174.5	-100.2	85.6	0	0	0	113.7	T624 K630	T624-L628 PolarHBondContact O-N 3.15Å; T624-L628 VanDerWaalsContact O-N 3.07Å; L628-K630 PolarHBondContact O-N 3.48Å
629	L	31.6	Very low	31.2	Very low	125 Å²	125	123.4 Å²	123.4	65%	0.654	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-4.9	172.8	-82.8	160	0	0	0	113.8	N627	N627-L629 PolarHBondContact O-N 3.43Å
630	K	32.6	Very low	31.2	Very low	139 Å²	139	124.1 Å²	124.1	60%	0.604	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-11.6	177.4	-60.4	177	178.2	169.5	0	113.8	N627 L628	N627-K630 VanDerWaalsContact O-CB 3.27Å; N627-K630 WeakPolarHBondContact O-CB 3.38Å; N627-K630 PolarHBondContact O-N 2.91Å; N627-K630 WeakPolarHBondContact OD1-CE 3.26Å; N627-K630 PolarHBondContact OD1-NZ 3.25Å; L628-K630 PolarHBondContact O-N 3.48Å
631	E	29.9	Very low	31.2	Very low	159 Å²	159	123.7 Å²	123.7	74%	0.743	65%	0.653	S	S	*	*	S	Bend	trans	-107.2	-1.7	-169.5	-64	-169.1	141.1	0	0	114.7
632	T	30.1	Very low	31.1	Very low	119 Å²	119	130 Å²	130	73%	0.73	67%	0.673	S	S	*	*	S	Bend	trans	-98.7	8.7	-177.2	18	0	0	0	0	115
633	T	30.6	Very low	31.2	Very low	117 Å²	117	131 Å²	131	72%	0.718	69%	0.686	S	S	*	*			trans	-125.8	62.8	175.5	45.9	0	0	0	0	112	G635	T633-G635 PolarHBondContact O-N 2.68Å
634	R	27.5	Very low	31.2	Very low	253 Å²	253	131.6 Å²	131.6	96%	0.955	68%	0.681	S	S	*	*			trans	-87.7	83.7	160.2	-80	-172.7	176.4	-177.5	0.7	109.3
635	G	28.4	Very low	31.3	Very low	57 Å²	57	132 Å²	132	59%	0.588	68%	0.684	S	S	*	*	S	Bend	trans	175.2	126.4	178	0	0	0	0	0	110.8	T633	T633-G635 PolarHBondContact O-N 2.68Å
636	D	31.6	Very low	31.4	Very low	169 Å²	169	127.5 Å²	127.5	90%	0.904	67%	0.671	S	S	*	*			trans	67.6	122.3	169.8	-54.9	-25.6	0	0	0	119.6
637	Q	28.1	Very low	31.5	Very low	202 Å²	202	127.1 Å²	127.1	94%	0.944	68%	0.679	S	S	*	*			trans	-87.1	112.3	-176.7	-62.3	173.2	-4.7	0	0	110.7
638	S	31.6	Very low	32	Very low	114 Å²	114	125.1 Å²	125.1	80%	0.797	67%	0.668	S	S	*	*			trans	-151	129.9	152.4	54.4	0	0	0	0	110.2	E640	S638-E640 PolarHBondContact O-N 3.14Å
639	N	27.1	Very low	32.7	Very low	175 Å²	175	121 Å²	121	94%	0.936	65%	0.646	S	S	*	*			trans	-88.3	105.5	-167.1	-74	-43.9	0	0	0	112.3
640	E	28.2	Very low	33.4	Very low	157 Å²	157	121.3 Å²	121.3	73%	0.734	65%	0.649	S	S	*	*			trans	-130.2	149.3	157.1	-86.5	-145.2	151.2	0	0	111.7	S638 Y642	S638-E640 PolarHBondContact O-N 3.14Å; E640-Y642 WeakPolarHBondContact O-CD2 3.24Å; E640-Y642 PolarHBondContact O-N 3.26Å
641	P	29.4	Very low	34.4	Very low	93 Å²	93	120.6 Å²	120.6	60%	0.604	65%	0.646	S	S	*	*			trans	-82.5	90.6	-166.5	32.4	-36	0	0	0	113.7	S643	P641-S643 PolarHBondContact O-N 3.36Å
642	Y	29.2	Very low	35.8	Very low	205 Å²	205	116.1 Å²	116.1	80%	0.804	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	9.4	177.2	-87	-89.9	0	0	0	116.6	E640	E640-Y642 WeakPolarHBondContact O-CD2 3.24Å; E640-Y642 PolarHBondContact O-N 3.26Å
643	S	34.6	Very low	37.8	Very low	94 Å²	94	113.2 Å²	113.2	66%	0.657	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-16.2	-176.3	62	0	0	0	0	115.4	P641	P641-S643 PolarHBondContact O-N 3.36Å
644	Q	34.3	Very low	39.8	Very low	113 Å²	113	108.4 Å²	108.4	53%	0.528	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.6	-19.6	-171.8	-67.3	-171.1	7.1	0	0	115.3
645	T	36.1	Very low	41.7	Very low	80 Å²	80	99.8 Å²	99.8	49%	0.491	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-34.5	-177.2	41.2	0	0	0	0	112.8	L648	T645-L648 WeakPolarHBondContact O-CB 3.41Å; T645-L648 PolarHBondContact O-N 2.82Å
646	S	38.6	Very low	43.8	Very low	53 Å²	53	102.1 Å²	102.1	37%	0.371	54%	0.538	S	S	.	.	H	α-helix	trans	-60.2	-51.6	179.8	-163.2	0	0	0	0	112	L648 L649	S646-L648 PolarHBondContact O-N 2.96Å; S646-L648 VanDerWaalsContact O-N 3.09Å; S646-L649 PolarHBondContact O-N 3.31Å
647	G	38.7	Very low	46.2	Very low	41 Å²	41	94.3 Å²	94.3	42%	0.423	50%	0.496	S	S	.	.	H	α-helix	trans	-70.3	-4.2	-179.6	0	0	0	0	0	115.4
648	L	40.1	Very low	48.5	Very low	36 Å²	36	84.7 Å²	84.7	19%	0.188	45%	0.452	C	S	.	.	H	α-helix	trans	-85.1	-40.3	174.9	-116.4	162	0	0	0	111	F575 T645 S646 D650 K651 W652	F575-L648 HydrophobicContact CD1-CD2 4.38Å; F575-L648 HydrophobicContact CE1-CD2 3.68Å; F575-L648 HydrophobicContact CE2-CD2 4.38Å; F575-L648 HydrophobicContact CZ-CD2 3.66Å; T645-L648 WeakPolarHBondContact O-CB 3.41Å; T645-L648 PolarHBondContact O-N 2.82Å; S646-L648 PolarHBondContact O-N 2.96Å; S646-L648 VanDerWaalsContact O-N 3.09Å; L648-D650 VanDerWaalsContact C-N 3.32Å; L648-K651 PolarHBondContact O-N 3.37Å; L648-W652 PolarHBondContact O-N 3.41Å
649	L	47.8	Very low	50.5	Low	39 Å²	39	82.7 Å²	82.7	20%	0.204	43%	0.431	C	S	.	.	H	α-helix	trans	-64.6	-35.9	174.6	-70.7	162.9	0	0	0	111.6	Y586 L621 S646 K651 W652	Y586-L649 HydrophobicContact CD1-CD2 3.96Å; Y586-L649 HydrophobicContact CE1-CD1 4.25Å; Y586-L649 HydrophobicContact CE1-CD2 3.75Å; L621-L649 HydrophobicContact CD2-CD1 3.94Å; S646-L649 PolarHBondContact O-N 3.31Å; L649-K651 PolarHBondContact O-N 3.33Å; L649-W652 CarbonylContact O-C 3.3Å; L649-W652 VanDerWaalsContact O-C 3.3Å; L649-W652 PolarHBondContact O-N 3.25Å
650	D	46.4	Very low	53.1	Low	133 Å²	133	76 Å²	76	71%	0.711	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.9	174.8	-63.9	-27.5	0	0	0	113.4	L648	L648-D650 VanDerWaalsContact C-N 3.32Å
651	K	53.4	Low	55.7	Low	123 Å²	123	70.1 Å²	70.1	54%	0.535	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-38.1	175.5	-78.6	-179	170.2	174.3	0	112.7	L648 L649 K656	L648-K651 PolarHBondContact O-N 3.37Å; L649-K651 PolarHBondContact O-N 3.33Å; K651-K656 PolarHBondContact O-NZ 2.74Å
652	W	60.7	Low	58.5	Low	66 Å²	66	67.1 Å²	67.1	25%	0.25	35%	0.345	C	S	.	.			trans	-123.4	92.7	-175.3	-69.9	83.8	0	0	0	111.2	F575 L648 L649 K656 L657 L660	F575-W652 HydrophobicContact CE2-CD2 4.34Å; F575-W652 AromaticContact CE2-CE2 3.98Å; F575-W652 HydrophobicContact CE2-CG 4.35Å; F575-W652 HydrophobicContact CE2-CZ2 4.48Å; F575-W652 AromaticContact CE2-NE1 3.81Å; F575-W652 AromaticContact CZ-CD1 3.56Å; F575-W652 AromaticContact CZ-CE2 3.99Å; F575-W652 HydrophobicContact CZ-CG 4.29Å; F575-W652 AromaticContact CZ-NE1 3.36Å; L648-W652 PolarHBondContact O-N 3.41Å; L649-W652 CarbonylContact O-C 3.3Å; L649-W652 VanDerWaalsContact O-C 3.3Å; L649-W652 PolarHBondContact O-N 3.25Å; W652-K656 HydrophobicContact CE3-CB 3.79Å; W652-K656 HydrophobicContact CZ3-CB 4.05Å; W652-L657 HydrophobicContact CB-CD1 4.42Å; W652-L657 HydrophobicContact CB-CD2 4.49Å; W652-L657 HydrophobicContact CB-CG 4.42Å; W652-L657 HydrophobicContact CD2-CD2 4.45Å; W652-L657 HydrophobicContact CE3-CD2 3.78Å; W652-L657 HydrophobicContact CE3-CG 4.07Å; W652-L657 HydrophobicContact CZ3-CD2 4.44Å; W652-L660 HydrophobicContact CH2-CD1 4.48Å; W652-L660 HydrophobicContact CH2-CD2 4.32Å; W652-L660 HydrophobicContact CZ3-CD1 3.84Å; W652-L660 HydrophobicContact CZ3-CD2 4.12Å; W652-L660 HydrophobicContact CZ3-CG 4.27Å
653	N	70.9	Confident	61.4	Low	57 Å²	57	57.3 Å²	57.3	31%	0.305	31%	0.306	S	S	.	.			trans	-75	163	162.5	60.2	-16.1	0	0	0	110.7	D655 K656 L657	N653-D655 PolarHBondContact ND2-OD2 3Å; N653-D655 PolarHBondContact O-N 3.42Å; N653-D655 VanDerWaalsContact O-N 3.12Å; N653-K656 PolarHBondContact O-N 3.41Å; N653-K656 WeakPolarHBondContact OD1-CD 3.25Å; N653-K656 WeakPolarHBondContact OD1-CE 3.43Å; N653-K656 VanDerWaalsContact OD1-CG 3.25Å; N653-K656 WeakPolarHBondContact OD1-CG 3.06Å; N653-K656 PolarHBondContact OD1-N 2.92Å; N653-L657 WeakPolarHBondContact O-CD1 3.47Å; N653-L657 PolarHBondContact O-N 3.4Å
654	F	73	Confident	64	Low	16 Å²	16	52.9 Å²	52.9	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-56.6	-27.8	176.9	-63	-40.1	0	0	0	113.2	R391 Y586 Y587 Y590 L657 E658	R391-F654 PolarHBondContact NH2-O 3.17Å; Y586-F654 AromaticContact CD1-CE1 3.82Å; Y586-F654 HydrophobicContact CD1-CE1 3.82Å; Y586-F654 AromaticContact CD1-CZ 3.52Å; Y586-F654 HydrophobicContact CD1-CZ 3.52Å; Y586-F654 HydrophobicContact CE1-CE1 4.07Å; Y586-F654 HydrophobicContact CE1-CE2 4.21Å; Y586-F654 AromaticContact CE1-CZ 3.43Å; Y586-F654 HydrophobicContact CE1-CZ 3.43Å; Y586-F654 VanDerWaalsContact CE1-CZ 3.43Å; Y587-F654 AromaticContact CD2-CD1 3.67Å; Y587-F654 HydrophobicContact CD2-CD1 3.67Å; Y587-F654 AromaticContact CD2-CE1 3.84Å; Y587-F654 HydrophobicContact CD2-CE1 3.84Å; Y587-F654 HydrophobicContact CD2-CG 4.19Å; Y587-F654 HydrophobicContact CD2-CZ 4.48Å; Y587-F654 HydrophobicContact CG-CD1 4.49Å; Y587-F654 HydrophobicContact CG-CE1 4.36Å; Y590-F654 HydrophobicContact CD1-CD2 4.05Å; Y590-F654 AromaticContact CD1-CE2 3.56Å; Y590-F654 HydrophobicContact CD1-CE2 3.56Å; Y590-F654 HydrophobicContact CD1-CZ 4.38Å; Y590-F654 AromaticContact CD2-CE2 3.88Å; Y590-F654 HydrophobicContact CD2-CE2 3.88Å; Y590-F654 HydrophobicContact CE1-CD2 4.14Å; Y590-F654 AromaticContact CE1-CE2 3.98Å; Y590-F654 HydrophobicContact CE1-CE2 3.98Å; Y590-F654 HydrophobicContact CE2-CE2 4.27Å; Y590-F654 HydrophobicContact CG-CD2 4.43Å; Y590-F654 AromaticContact CG-CE2 3.51Å; Y590-F654 HydrophobicContact CG-CE2 3.51Å; Y590-F654 HydrophobicContact CG-CZ 4.07Å; F654-L657 HydrophobicContact CD1-CD1 4.1Å; F654-L657 PolarHBondContact O-N 2.99Å; F654-E658 WeakPolarHBondContact O-CG 3.48Å; F654-E658 PolarHBondContact O-N 3.32Å
655	D	67.3	Low	66.5	Low	73 Å²	73	47.5 Å²	47.5	39%	0.39	25%	0.25	S	C	.	.	H	α-helix	trans	-60.9	-48.2	179.1	-52	-51.7	0	0	0	111.8	R391 N653 L657 L659	R391-D655 IonicContact CZ-OD1 2.74Å; R391-D655 IonicContact NH1-OD1 2.84Å; R391-D655 PolarHBondContact NH1-OD1 2.92Å; R391-D655 IonicContact NH1-OD2 3.1Å; R391-D655 IonicContact NH2-OD1 2.69Å; R391-D655 PolarHBondContact NH2-OD1 3.22Å; N653-D655 PolarHBondContact ND2-OD2 3Å; N653-D655 PolarHBondContact O-N 3.42Å; N653-D655 VanDerWaalsContact O-N 3.12Å; D655-L657 VanDerWaalsContact C-N 3.29Å; D655-L657 PolarHBondContact O-N 3.14Å; D655-L659 WeakPolarHBondContact O-CB 3.47Å; D655-L659 WeakPolarHBondContact O-CD1 2.87Å; D655-L659 WeakPolarHBondContact O-CG 3.46Å; D655-L659 PolarHBondContact O-N 3.21Å
656	K	73.6	Confident	68.7	Low	106 Å²	106	44 Å²	44	46%	0.461	23%	0.23	S	C	.	.	H	α-helix	trans	-66.6	-33.6	176.5	-68.2	170.9	-162.1	174.3	0	112.1	K651 W652 N653 L660	K651-K656 PolarHBondContact O-NZ 2.74Å; W652-K656 HydrophobicContact CE3-CB 3.79Å; W652-K656 HydrophobicContact CZ3-CB 4.05Å; N653-K656 PolarHBondContact O-N 3.41Å; N653-K656 WeakPolarHBondContact OD1-CD 3.25Å; N653-K656 WeakPolarHBondContact OD1-CE 3.43Å; N653-K656 VanDerWaalsContact OD1-CG 3.25Å; N653-K656 WeakPolarHBondContact OD1-CG 3.06Å; N653-K656 PolarHBondContact OD1-N 2.92Å; K656-L660 WeakPolarHBondContact O-CG 3.37Å
657	L	80.1	Confident	71	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-74.3	-47.3	-175.4	-68.9	159.1	0	0	0	112.3	L583 W652 N653 F654 D655 L659 L660 W663	L583-L657 HydrophobicContact CD1-CD1 4.46Å; L583-L657 HydrophobicContact CD2-CD1 3.28Å; L583-L657 HydrophobicContact CD2-CD2 4.02Å; L583-L657 HydrophobicContact CD2-CG 4.28Å; L583-L657 HydrophobicContact CG-CD1 4.47Å; W652-L657 HydrophobicContact CB-CD1 4.42Å; W652-L657 HydrophobicContact CB-CD2 4.49Å; W652-L657 HydrophobicContact CB-CG 4.42Å; W652-L657 HydrophobicContact CD2-CD2 4.45Å; W652-L657 HydrophobicContact CE3-CD2 3.78Å; W652-L657 HydrophobicContact CE3-CG 4.07Å; W652-L657 HydrophobicContact CZ3-CD2 4.44Å; N653-L657 WeakPolarHBondContact O-CD1 3.47Å; N653-L657 PolarHBondContact O-N 3.4Å; F654-L657 HydrophobicContact CD1-CD1 4.1Å; F654-L657 PolarHBondContact O-N 2.99Å; D655-L657 VanDerWaalsContact C-N 3.29Å; D655-L657 PolarHBondContact O-N 3.14Å; L657-L659 PolarHBondContact O-N 3.28Å; L657-L660 HydrophobicContact CD2-CD1 4.1Å; L657-L660 VanDerWaalsContact O-CB 3.27Å; L657-L660 WeakPolarHBondContact O-CB 3.45Å; L657-L660 WeakPolarHBondContact O-CG 3.45Å; L657-L660 PolarHBondContact O-N 3.19Å; L657-W663 HydrophobicContact CB-CD2 4.37Å; L657-W663 HydrophobicContact CD2-CE3 4.26Å; L657-W663 HydrophobicContact CD2-CH2 4.32Å; L657-W663 HydrophobicContact CD2-CZ3 4.1Å; L657-W663 WeakPolarHBondContact O-CB 3.35Å
658	E	77.7	Confident	73.4	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-65.4	-31.6	179.4	-68.2	-176.3	138	0	0	111.9	R391 N395 R399 Y587 F654 L660 I665	R391-E658 WeakPolarHBondContact CG-OE2 3.47Å; R391-E658 IonicContact CZ-OE2 3.83Å; R391-E658 IonicContact NE-OE1 3.96Å; R391-E658 IonicContact NE-OE2 3.93Å; R391-E658 PolarHBondContact NE-OE2 3.02Å; R391-E658 IonicContact NH2-OE2 2.62Å; R391-E658 PolarHBondContact NH2-OE2 3.29Å; N395-E658 HydrophobicContact CB-CB 4.49Å; N395-E658 PolarHBondContact ND2-OE2 3.44Å; R399-E658 PolarHBondContact NH1-O 3.08Å; R399-E658 VanDerWaalsContact NH1-O 3.08Å; Y587-E658 HydrophobicContact CE2-CG 3.81Å; Y587-E658 VanDerWaalsContact CE2-OE1 3.23Å; Y587-E658 WeakPolarHBondContact CE2-OE1 3.31Å; Y587-E658 PolarHBondContact OH-OE1 2.83Å; F654-E658 WeakPolarHBondContact O-CG 3.48Å; F654-E658 PolarHBondContact O-N 3.32Å; E658-L660 PolarHBondContact O-N 2.94Å; E658-I665 HydrophobicContact CB-CD1 3.87Å; E658-I665 HydrophobicContact CB-CG1 3.86Å; E658-I665 HydrophobicContact CG-CD1 4.49Å; E658-I665 HydrophobicContact CG-CG1 4.07Å; E658-I665 WeakPolarHBondContact O-CD1 3.34Å
659	L	73.6	Confident	75.6	Confident	71 Å²	71	41.1 Å²	41.1	37%	0.372	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.7	172.9	-69.8	176.5	0	0	0	114.4	H398 D655 L657 E661	H398-L659 WeakPolarHBondContact ND1-CD2 3.31Å; D655-L659 WeakPolarHBondContact O-CB 3.47Å; D655-L659 WeakPolarHBondContact O-CD1 2.87Å; D655-L659 WeakPolarHBondContact O-CG 3.46Å; D655-L659 PolarHBondContact O-N 3.21Å; L657-L659 PolarHBondContact O-N 3.28Å; L659-E661 PolarHBondContact O-N 3.11Å
660	L	81.8	Confident	77.1	Confident	34 Å²	34	39.4 Å²	39.4	18%	0.178	19%	0.192	C	C	.	.	S	Bend	trans	-73.7	118.2	172	-59.7	166.3	0	0	0	109.7	R399 W652 K656 L657 E658 W662 W663	R399-L660 PolarHBondContact NH1-O 3.41Å; W652-L660 HydrophobicContact CH2-CD1 4.48Å; W652-L660 HydrophobicContact CH2-CD2 4.32Å; W652-L660 HydrophobicContact CZ3-CD1 3.84Å; W652-L660 HydrophobicContact CZ3-CD2 4.12Å; W652-L660 HydrophobicContact CZ3-CG 4.27Å; K656-L660 WeakPolarHBondContact O-CG 3.37Å; L657-L660 HydrophobicContact CD2-CD1 4.1Å; L657-L660 VanDerWaalsContact O-CB 3.27Å; L657-L660 WeakPolarHBondContact O-CB 3.45Å; L657-L660 WeakPolarHBondContact O-CG 3.45Å; L657-L660 PolarHBondContact O-N 3.19Å; E658-L660 PolarHBondContact O-N 2.94Å; L660-W662 HydrophobicContact CB-CD2 4.43Å; L660-W662 HydrophobicContact CD1-CH2 3.99Å; L660-W662 HydrophobicContact CD1-CZ2 3.59Å; L660-W662 HydrophobicContact CD2-CZ2 4.4Å; L660-W662 HydrophobicContact CG-CZ2 4.4Å; L660-W662 PolarHBondContact O-N 3.49Å; L660-W663 HydrophobicContact CB-CB 3.93Å; L660-W663 WeakPolarHBondContact O-CB 3.41Å; L660-W663 PolarHBondContact O-N 3.31Å
661	E	82.7	Confident	78.8	Confident	34 Å²	34	33.5 Å²	33.5	16%	0.159	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.3	-179.7	-61	176.7	163.5	0	0	113.5	R399 L403 S406 V566 R567 L659	R399-E661 PolarHBondContact NH2-O 3.37Å; L403-E661 HydrophobicContact CD2-CG 4.47Å; S406-E661 PolarHBondContact OG-OE1 3.06Å; V566-E661 CarbonylContact C-O 3.51Å; V566-E661 WeakPolarHBondContact CA-O 3.28Å; R567-E661 HydrophobicContact CB-CB 3.84Å; R567-E661 WeakPolarHBondContact CD-OE2 3.4Å; R567-E661 IonicContact CZ-OE2 3.33Å; R567-E661 PolarHBondContact N-O 2.96Å; R567-E661 IonicContact NE-OE2 3.2Å; R567-E661 IonicContact NH1-OE2 3.61Å; R567-E661 PolarHBondContact NH1-OE2 2.81Å; L659-E661 PolarHBondContact O-N 3.11Å
662	W	88.1	Confident	80.3	Confident	30 Å²	30	28.3 Å²	28.3	11%	0.114	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-7.7	176.4	58.1	-94.4	0	0	0	114.3	R567 P569 P574 L580 L660 F688	R567-W662 HydrophobicContact CB-CB 4.37Å; R567-W662 WeakPolarHBondContact O-CA 3.27Å; R567-W662 WeakPolarHBondContact O-CB 3.47Å; P569-W662 HydrophobicContact CB-CB 3.93Å; P569-W662 HydrophobicContact CB-CD2 4.01Å; P569-W662 HydrophobicContact CB-CE3 4.11Å; P569-W662 HydrophobicContact CB-CG 3.96Å; P574-W662 HydrophobicContact CG-CH2 4.05Å; P574-W662 HydrophobicContact CG-CZ2 3.85Å; L580-W662 HydrophobicContact CD2-CH2 4.07Å; L580-W662 HydrophobicContact CD2-CZ3 4.39Å; L660-W662 HydrophobicContact CB-CD2 4.43Å; L660-W662 HydrophobicContact CD1-CH2 3.99Å; L660-W662 HydrophobicContact CD1-CZ2 3.59Å; L660-W662 HydrophobicContact CD2-CZ2 4.4Å; L660-W662 HydrophobicContact CG-CZ2 4.4Å; L660-W662 PolarHBondContact O-N 3.49Å; W662-F688 HydrophobicContact CE3-CD1 4.29Å; W662-F688 HydrophobicContact CE3-CE1 4.47Å; W662-F688 AromaticContact CZ3-CD1 3.95Å; W662-F688 HydrophobicContact CZ3-CD1 3.95Å; W662-F688 AromaticContact CZ3-CE1 3.86Å; W662-F688 HydrophobicContact CZ3-CE1 3.86Å
663	W	89.5	Confident	81.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-78.9	130	175.9	-171.1	-96.2	0	0	0	110.6	R399 L583 Y584 Y587 L657 L660 I665 F688	R399-W663 PolarHBondContact NH1-O 2.97Å; R399-W663 PolarHBondContact NH2-O 3.24Å; L583-W663 HydrophobicContact CD2-CH2 3.6Å; L583-W663 HydrophobicContact CD2-CZ2 4.09Å; L583-W663 HydrophobicContact CD2-CZ3 4.46Å; Y584-W663 HydrophobicContact CD2-CH2 4Å; Y584-W663 AromaticContact CD2-CZ2 3.64Å; Y584-W663 HydrophobicContact CD2-CZ2 3.64Å; Y584-W663 HydrophobicContact CE2-CZ2 4.49Å; Y587-W663 HydrophobicContact CD1-CZ2 4.04Å; Y587-W663 AromaticContact CD1-NE1 3.56Å; Y587-W663 AromaticContact CE1-NE1 3.5Å; Y587-W663 AromaticContact CG-CZ2 3.97Å; Y587-W663 HydrophobicContact CG-CZ2 3.97Å; Y587-W663 AromaticContact CG-NE1 3.94Å; Y587-W663 AromaticContact CZ-NE1 3.84Å; L657-W663 HydrophobicContact CB-CD2 4.37Å; L657-W663 HydrophobicContact CD2-CE3 4.26Å; L657-W663 HydrophobicContact CD2-CH2 4.32Å; L657-W663 HydrophobicContact CD2-CZ3 4.1Å; L657-W663 WeakPolarHBondContact O-CB 3.35Å; L660-W663 HydrophobicContact CB-CB 3.93Å; L660-W663 WeakPolarHBondContact O-CB 3.41Å; L660-W663 PolarHBondContact O-N 3.31Å; W663-I665 PolarHBondContact O-N 2.99Å; W663-F688 AromaticContact CE3-CE1 3.94Å; W663-F688 HydrophobicContact CE3-CE1 3.94Å; W663-F688 HydrophobicContact CE3-CZ 4.41Å; W663-F688 HydrophobicContact CH2-CZ 4.3Å; W663-F688 AromaticContact CZ3-CE1 3.75Å; W663-F688 HydrophobicContact CZ3-CE1 3.75Å; W663-F688 AromaticContact CZ3-CZ 3.8Å; W663-F688 HydrophobicContact CZ3-CZ 3.8Å
664	P	89.7	Confident	82.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.133	C	C	.	.			trans	-78.9	85	176.6	29.1	-30.2	0	0	0	110.7	V566 Y584 P687 Y693	V566-P664 HydrophobicContact CG1-CB 4.15Å; Y584-P664 HydrophobicContact CD2-CG 4.38Å; Y584-P664 HydrophobicContact CE2-CG 3.62Å; P664-P687 HydrophobicContact CG-CB 4.06Å; P664-Y693 WeakPolarHBondContact CB-OH 3.41Å
665	I	86.9	Confident	83	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	141.1	171.5	-75	-175.7	0	0	0	110.7	I392 N395 R542 E658 W663 G667	I392-I665 HydrophobicContact CG2-CG2 3.9Å; N395-I665 HydrophobicContact CB-CD1 3.75Å; R542-I665 PolarHBondContact NH1-O 3.02Å; E658-I665 HydrophobicContact CB-CD1 3.87Å; E658-I665 HydrophobicContact CB-CG1 3.86Å; E658-I665 HydrophobicContact CG-CD1 4.49Å; E658-I665 HydrophobicContact CG-CG1 4.07Å; E658-I665 WeakPolarHBondContact O-CD1 3.34Å; W663-I665 PolarHBondContact O-N 2.99Å; I665-G667 VanDerWaalsContact C-N 3.27Å; I665-G667 PolarHBondContact O-N 2.81Å
666	G	82.3	Confident	84.2	Confident	8 Å²	8	23.9 Å²	23.9	8%	0.082	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	12.6	169.1	0	0	0	0	0	114.7	Y587	Y587-G666 PolarHBondContact OH-N 3.42Å
667	G	86.8	Confident	85.1	Confident	6 Å²	6	18.9 Å²	18.9	6%	0.062	10%	0.096	C	C	.	.			trans	88.8	-177.9	179.1	0	0	0	0	0	113.4	R542 Y584 I665 I670	R542-G667 PolarHBondContact NH2-O 3.28Å; Y584-G667 VanDerWaalsContact OH-CA 3.25Å; Y584-G667 WeakPolarHBondContact OH-CA 3.29Å; I665-G667 VanDerWaalsContact C-N 3.27Å; I665-G667 PolarHBondContact O-N 2.81Å; G667-I670 WeakPolarHBondContact O-CG2 3.29Å
668	I	88.8	Confident	85.7	Confident	21 Å²	21	19.5 Å²	19.5	11%	0.108	10%	0.101	C	C	.	.	S	Bend	trans	-67.3	-49.3	177.4	-73.9	166.5	0	0	0	110.4	Y584 I670 L680 K683 I685	Y584-I668 HydrophobicContact CE1-CD1 4.31Å; Y584-I668 HydrophobicContact CE1-CG1 4.19Å; Y584-I668 PolarHBondContact OH-N 2.95Å; Y584-I668 VanDerWaalsContact OH-N 3.1Å; I668-I670 VanDerWaalsContact C-N 3.26Å; I668-I670 PolarHBondContact O-N 3.15Å; I668-L680 HydrophobicContact CG2-CD2 3.93Å; I668-K683 HydrophobicContact CD1-CB 4.46Å; I668-I685 HydrophobicContact CB-CG2 4.21Å; I668-I685 HydrophobicContact CD1-CG2 3.71Å; I668-I685 HydrophobicContact CG1-CG2 3.75Å; I668-I685 HydrophobicContact CG2-CG2 3.4Å
669	Q	87.1	Confident	86.4	Confident	41 Å²	41	20 Å²	20	19%	0.192	10%	0.103	C	C	.	.	S	Bend	trans	-87.9	55	-172.3	-69.3	173.9	-30.8	0	0	112.3	M676 L680 L681 K683 L843	Q669-M676 HydrophobicContact CB-CE 4.49Å; Q669-M676 HydrophobicContact CB-SD 4.46Å; Q669-L680 WeakPolarHBondContact CG-O 3.47Å; Q669-L680 PolarHBondContact NE2-O 2.79Å; Q669-L681 PolarHBondContact NE2-O 2.89Å; Q669-K683 VanDerWaalsContact CD-CG 3.47Å; Q669-K683 HydrophobicContact CG-CG 4.12Å; Q669-L843 HydrophobicContact CB-CD1 4.27Å; Q669-L843 HydrophobicContact CB-CD2 4.38Å; Q669-L843 HydrophobicContact CG-CD1 4.15Å; Q669-L843 HydrophobicContact CG-CD2 4.41Å
670	I	79.6	Confident	87.3	Confident	3 Å²	3	17 Å²	17	2%	0.015	9%	0.087	C	C	.	.			trans	-112.8	135.1	171	-168	160.4	0	0	0	109.8	F368 R542 L564 G667 I668	F368-I670 HydrophobicContact CE1-CD1 4.48Å; F368-I670 HydrophobicContact CZ-CD1 4.03Å; F368-I670 HydrophobicContact CZ-CG1 4.23Å; R542-I670 VanDerWaalsContact NH2-CG2 3.27Å; L564-I670 HydrophobicContact CD1-CG1 4.11Å; L564-I670 HydrophobicContact CD2-CD1 3.57Å; L564-I670 HydrophobicContact CD2-CG1 3.91Å; L564-I670 HydrophobicContact CD2-CG2 4.34Å; G667-I670 WeakPolarHBondContact O-CG2 3.29Å; I668-I670 VanDerWaalsContact C-N 3.26Å; I668-I670 PolarHBondContact O-N 3.15Å
671	G	80.5	Confident	87.7	Confident	10 Å²	10	15.7 Å²	15.7	10%	0.103	8%	0.08	C	C	.	.	S	Bend	trans	128.2	-175.3	-168.9	0	0	0	0	0	111	D543 M676	D543-G671 WeakPolarHBondContact OD1-CA 3.03Å; G671-M676 WeakPolarHBondContact O-CE 3.31Å
672	T	85.2	Confident	88.1	Confident	14 Å²	14	16.4 Å²	16.4	9%	0.086	9%	0.09	C	C	.	.			trans	-83.5	121.8	172.6	-73.7	0	0	0	0	111.1	D543 K545 R674 Y675	D543-T672 PolarHBondContact OD1-N 2.98Å; K545-T672 HydrophobicContact CD-CG2 4.45Å; K545-T672 WeakPolarHBondContact CD-OG1 3.16Å; K545-T672 PolarHBondContact NZ-OG1 3.06Å; T672-R674 HydrophobicContact CG2-CB 4.03Å; T672-R674 PolarHBondContact O-N 3.34Å; T672-R674 VanDerWaalsContact O-N 3.11Å; T672-Y675 HydrophobicContact CG2-CD2 3.87Å; T672-Y675 HydrophobicContact CG2-CE2 4.21Å; T672-Y675 PolarHBondContact O-N 3.17Å; T672-Y675 VanDerWaalsContact O-N 3.13Å
673	P	85.4	Confident	88.2	Confident	25 Å²	25	19.4 Å²	19.4	16%	0.162	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-53.9	-34.1	-175.5	-29.5	36.2	0	0	0	115.4	Y675 M676 M846	P673-Y675 PolarHBondContact O-N 3.49Å; P673-Y675 VanDerWaalsContact O-N 3.16Å; P673-M676 PolarHBondContact O-N 3.2Å; P673-M676 VanDerWaalsContact O-N 3.13Å; P673-M846 HydrophobicContact CB-CB 4.3Å; P673-M846 HydrophobicContact CB-CG 3.9Å
674	R	86.2	Confident	88.2	Confident	59 Å²	59	23.6 Å²	23.6	22%	0.223	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-54	-34	179.2	-172.8	-177.5	-64.7	-83.6	8.6	113.5	T672 M745	T672-R674 HydrophobicContact CG2-CB 4.03Å; T672-R674 PolarHBondContact O-N 3.34Å; T672-R674 VanDerWaalsContact O-N 3.11Å; R674-M745 HydrophobicContact CG-CE 4.25Å
675	Y	91.1	Very high	88.3	Confident	28 Å²	28	24.1 Å²	24.1	11%	0.11	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-103.8	2.3	-176.2	-58.2	-86.8	0	0	0	113.2	K545 P546 T672 P673 A677 L703 I704 E707	K545-Y675 HydrophobicContact CB-CD1 4.42Å; K545-Y675 HydrophobicContact CB-CD2 3.55Å; K545-Y675 HydrophobicContact CB-CE2 3.68Å; K545-Y675 HydrophobicContact CB-CG 3.97Å; P546-Y675 WeakPolarHBondContact CD-OH 3.13Å; P546-Y675 HydrophobicContact CG-CE1 4.39Å; P546-Y675 WeakPolarHBondContact CG-OH 3.41Å; T672-Y675 HydrophobicContact CG2-CD2 3.87Å; T672-Y675 HydrophobicContact CG2-CE2 4.21Å; T672-Y675 PolarHBondContact O-N 3.17Å; T672-Y675 VanDerWaalsContact O-N 3.13Å; P673-Y675 PolarHBondContact O-N 3.49Å; P673-Y675 VanDerWaalsContact O-N 3.16Å; Y675-A677 PolarHBondContact O-N 3.01Å; Y675-L703 HydrophobicContact CD1-CB 4.04Å; Y675-L703 HydrophobicContact CD1-CD1 4.07Å; Y675-L703 HydrophobicContact CE1-CB 4.21Å; Y675-I704 HydrophobicContact CD1-CG1 4.18Å; Y675-I704 HydrophobicContact CE1-CG1 3.96Å; Y675-E707 VanDerWaalsContact CE1-OE1 3.29Å; Y675-E707 WeakPolarHBondContact CE1-OE1 3.45Å; Y675-E707 PolarHBondContact OH-OE1 3.49Å
676	M	90.9	Very high	88.5	Confident	7 Å²	7	27.3 Å²	27.3	3%	0.034	15%	0.152	C	C	.	.			trans	-71.6	129.8	178.5	-72.8	-173.8	-176.7	0	0	111.1	Q669 G671 P673 L680 L681 Y699 L843	Q669-M676 HydrophobicContact CB-CE 4.49Å; Q669-M676 HydrophobicContact CB-SD 4.46Å; G671-M676 WeakPolarHBondContact O-CE 3.31Å; P673-M676 PolarHBondContact O-N 3.2Å; P673-M676 VanDerWaalsContact O-N 3.13Å; M676-L680 HydrophobicContact CB-CB 4.13Å; M676-L680 HydrophobicContact CB-CD1 4.37Å; M676-L680 HydrophobicContact CG-CB 4.43Å; M676-L680 HydrophobicContact CG-CD1 4.35Å; M676-L681 HydrophobicContact CB-CD2 3.7Å; M676-L681 HydrophobicContact CB-CG 3.8Å; M676-L681 WeakPolarHBondContact O-CD1 3.27Å; M676-L681 HydrophobicContact SD-CD2 4.19Å; M676-Y699 VanDerWaalsContact O-CE1 3.24Å; M676-Y699 WeakPolarHBondContact O-CE1 3.44Å; M676-L843 HydrophobicContact SD-CD1 3.83Å
677	A	93.3	Very high	88.8	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.151	C	C	.	.			trans	-65.1	156.5	173	0	0	0	0	0	112	Y675 E679 L680 L681 Y699	Y675-A677 PolarHBondContact O-N 3.01Å; A677-E679 VanDerWaalsContact CB-CD 3.45Å; A677-E679 WeakPolarHBondContact CB-OE1 3.44Å; A677-E679 WeakPolarHBondContact CB-OE2 3.19Å; A677-E679 PolarHBondContact O-N 3.22Å; A677-E679 VanDerWaalsContact O-N 3.14Å; A677-L680 HydrophobicContact CB-CG 4.48Å; A677-L680 WeakPolarHBondContact O-CB 3.47Å; A677-L680 PolarHBondContact O-N 2.68Å; A677-L681 PolarHBondContact O-N 2.64Å; A677-Y699 VanDerWaalsContact CA-CD1 3.43Å; A677-Y699 HydrophobicContact CB-CD1 3.84Å; A677-Y699 HydrophobicContact CB-CD2 4.38Å; A677-Y699 HydrophobicContact CB-CG 3.74Å
678	P	92.4	Very high	89	Confident	17 Å²	17	27.8 Å²	27.8	11%	0.11	15%	0.151	C	C	.	.	H	α-helix	trans	-49.9	-41.5	-179.1	-26.7	32.1	0	0	0	114.1	L680 L681 S682 Y699 V850 R856	P678-L680 VanDerWaalsContact C-N 3.31Å; P678-L680 PolarHBondContact O-N 2.93Å; P678-L681 PolarHBondContact O-N 2.82Å; P678-S682 WeakPolarHBondContact O-CB 3.41Å; P678-S682 PolarHBondContact O-N 3.31Å; P678-S682 PolarHBondContact O-OG 2.78Å; P678-S682 VanDerWaalsContact O-OG 3.04Å; P678-Y699 HydrophobicContact CG-CE2 4.37Å; P678-V850 HydrophobicContact CB-CG1 4.41Å; P678-V850 HydrophobicContact CG-CG1 3.82Å; P678-R856 VanDerWaalsContact CG-NH2 3.31Å
679	E	93.1	Very high	89.1	Confident	12 Å²	12	28.6 Å²	28.6	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-71	-20.3	179.9	67.6	-81.2	-171.8	0	0	114.5	A677 S682 S684 I685 R980	A677-E679 VanDerWaalsContact CB-CD 3.45Å; A677-E679 WeakPolarHBondContact CB-OE1 3.44Å; A677-E679 WeakPolarHBondContact CB-OE2 3.19Å; A677-E679 PolarHBondContact O-N 3.22Å; A677-E679 VanDerWaalsContact O-N 3.14Å; E679-S682 WeakPolarHBondContact CA-OG 3.2Å; E679-S682 PolarHBondContact O-OG 2.84Å; E679-S684 PolarHBondContact O-N 3.33Å; E679-I685 HydrophobicContact CB-CB 4.47Å; E679-I685 HydrophobicContact CG-CB 4.32Å; E679-I685 PolarHBondContact O-N 3.16Å; E679-I685 VanDerWaalsContact O-N 3.12Å; E679-R980 IonicContact OE1-CZ 2.68Å; E679-R980 IonicContact OE1-NH1 3.58Å; E679-R980 PolarHBondContact OE1-NH1 3.22Å; E679-R980 IonicContact OE1-NH2 3.2Å; E679-R980 IonicContact OE2-CZ 3.74Å; E679-R980 IonicContact OE2-NH1 2.64Å; E679-R980 PolarHBondContact OE2-NH1 2.82Å; E679-R980 IonicContact OE2-NH2 2.77Å; E679-R980 PolarHBondContact OE2-NH2 2.99Å
680	L	92.3	Very high	89.4	Confident	8 Å²	8	27.3 Å²	27.3	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-81	-46.2	168.4	-61.2	-179.8	0	0	0	109.7	I668 Q669 M676 A677 P678 S682 K683 I685 Y693	I668-L680 HydrophobicContact CG2-CD2 3.93Å; Q669-L680 WeakPolarHBondContact CG-O 3.47Å; Q669-L680 PolarHBondContact NE2-O 2.79Å; M676-L680 HydrophobicContact CB-CB 4.13Å; M676-L680 HydrophobicContact CB-CD1 4.37Å; M676-L680 HydrophobicContact CG-CB 4.43Å; M676-L680 HydrophobicContact CG-CD1 4.35Å; A677-L680 HydrophobicContact CB-CG 4.48Å; A677-L680 WeakPolarHBondContact O-CB 3.47Å; A677-L680 PolarHBondContact O-N 2.68Å; P678-L680 VanDerWaalsContact C-N 3.31Å; P678-L680 PolarHBondContact O-N 2.93Å; L680-S682 VanDerWaalsContact C-N 3.3Å; L680-S682 PolarHBondContact O-N 3.26Å; L680-K683 PolarHBondContact O-N 2.84Å; L680-K683 VanDerWaalsContact O-N 3.11Å; L680-I685 HydrophobicContact CD2-CB 4.48Å; L680-I685 HydrophobicContact CD2-CD1 3.85Å; L680-I685 HydrophobicContact CD2-CG2 3.97Å; L680-Y693 HydrophobicContact CD2-CE1 4.37Å
681	L	90.6	Very high	90	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-34.1	179.1	-67.5	173.1	0	0	0	112.9	Q669 M676 A677 P678 L843 M846 Y847 V850	Q669-L681 PolarHBondContact NE2-O 2.89Å; M676-L681 HydrophobicContact CB-CD2 3.7Å; M676-L681 HydrophobicContact CB-CG 3.8Å; M676-L681 WeakPolarHBondContact O-CD1 3.27Å; M676-L681 HydrophobicContact SD-CD2 4.19Å; A677-L681 PolarHBondContact O-N 2.64Å; P678-L681 PolarHBondContact O-N 2.82Å; L681-L843 HydrophobicContact CD2-CD1 3.71Å; L681-M846 HydrophobicContact CD1-CB 4.28Å; L681-M846 HydrophobicContact CD2-CB 3.89Å; L681-Y847 HydrophobicContact CB-CD2 4.23Å; L681-V850 HydrophobicContact CD1-CB 3.67Å; L681-V850 HydrophobicContact CD1-CG1 3.73Å; L681-V850 HydrophobicContact CD1-CG2 4.13Å
682	S	90.4	Very high	90.6	Very high	50 Å²	50	33 Å²	33	35%	0.35	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-7.8	175.8	65	0	0	0	0	114.6	P678 E679 L680 S684	P678-S682 WeakPolarHBondContact O-CB 3.41Å; P678-S682 PolarHBondContact O-N 3.31Å; P678-S682 PolarHBondContact O-OG 2.78Å; P678-S682 VanDerWaalsContact O-OG 3.04Å; E679-S682 WeakPolarHBondContact CA-OG 3.2Å; E679-S682 PolarHBondContact O-OG 2.84Å; L680-S682 VanDerWaalsContact C-N 3.3Å; L680-S682 PolarHBondContact O-N 3.26Å; S682-S684 PolarHBondContact O-N 3.11Å; S682-S684 VanDerWaalsContact OG-CB 3.24Å; S682-S684 WeakPolarHBondContact OG-CB 3.5Å; S682-S684 PolarHBondContact OG-N 3.21Å; S682-S684 VanDerWaalsContact OG-N 3.09Å; S682-S684 PolarHBondContact OG-OG 3.49Å
683	K	89.4	Confident	91	Very high	93 Å²	93	32.5 Å²	32.5	40%	0.404	18%	0.175	S	C	.	.	S	Bend	trans	55.5	20.9	-162.9	-55.9	-172.8	-178.8	-179.6	0	114.5	E592 I668 Q669 L680 I685	E592-K683 IonicContact OE1-NZ 3.68Å; E592-K683 PolarHBondContact OE1-NZ 2.88Å; E592-K683 IonicContact OE2-NZ 2.71Å; I668-K683 HydrophobicContact CD1-CB 4.46Å; Q669-K683 VanDerWaalsContact CD-CG 3.47Å; Q669-K683 HydrophobicContact CG-CG 4.12Å; L680-K683 PolarHBondContact O-N 2.84Å; L680-K683 VanDerWaalsContact O-N 3.11Å; K683-I685 VanDerWaalsContact C-N 3.35Å; K683-I685 PolarHBondContact O-N 3.33Å
684	S	90.9	Very high	91.5	Very high	88 Å²	88	33.1 Å²	33.1	62%	0.615	18%	0.175	S	C	*	.			trans	-83.3	-4.2	-177.4	72.3	0	0	0	0	114.9	E679 S682	E679-S684 PolarHBondContact O-N 3.33Å; S682-S684 PolarHBondContact O-N 3.11Å; S682-S684 VanDerWaalsContact OG-CB 3.24Å; S682-S684 WeakPolarHBondContact OG-CB 3.5Å; S682-S684 PolarHBondContact OG-N 3.21Å; S682-S684 VanDerWaalsContact OG-N 3.09Å; S682-S684 PolarHBondContact OG-OG 3.49Å
685	I	91.2	Very high	92	Very high	10 Å²	10	32 Å²	32	5%	0.051	17%	0.172	C	C	.	.	S	Bend	trans	-66.4	139.3	174.4	-171	163.2	0	0	0	112.1	I668 E679 L680 K683 P687 S692 Y693	I668-I685 HydrophobicContact CB-CG2 4.21Å; I668-I685 HydrophobicContact CD1-CG2 3.71Å; I668-I685 HydrophobicContact CG1-CG2 3.75Å; I668-I685 HydrophobicContact CG2-CG2 3.4Å; E679-I685 HydrophobicContact CB-CB 4.47Å; E679-I685 HydrophobicContact CG-CB 4.32Å; E679-I685 PolarHBondContact O-N 3.16Å; E679-I685 VanDerWaalsContact O-N 3.12Å; L680-I685 HydrophobicContact CD2-CB 4.48Å; L680-I685 HydrophobicContact CD2-CD1 3.85Å; L680-I685 HydrophobicContact CD2-CG2 3.97Å; K683-I685 VanDerWaalsContact C-N 3.35Å; K683-I685 PolarHBondContact O-N 3.33Å; I685-P687 WeakPolarHBondContact O-CD 3.3Å; I685-S692 VanDerWaalsContact CD1-CB 3.5Å; I685-Y693 HydrophobicContact CD1-CD1 3.73Å; I685-Y693 HydrophobicContact CD1-CE1 3.74Å; I685-Y693 HydrophobicContact CD1-CG 4.14Å
686	N	90.1	Very high	92.2	Very high	68 Å²	68	30.9 Å²	30.9	36%	0.364	17%	0.168	S	C	.	.			trans	-75.1	118.7	166.8	176	-26.3	0	0	0	109.2	H581 F688 C689	H581-N686 PolarHBondContact NE2-OD1 3.03Å; N686-F688 PolarHBondContact O-N 3.49Å; N686-F688 PolarHBondContact OD1-N 3.08Å; N686-C689 HydrophobicContact CB-CB 3.84Å; N686-C689 PolarHBondContact O-N 2.96Å; N686-C689 PolarHBondContact OD1-N 2.96Å
687	P	90.2	Very high	92.5	Very high	8 Å²	8	30.6 Å²	30.6	5%	0.052	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.5	-173.8	27.8	-36	0	0	0	114.7	Y584 P664 I685 Y693	Y584-P687 HydrophobicContact CD1-CB 3.78Å; Y584-P687 HydrophobicContact CD1-CG 3.58Å; Y584-P687 HydrophobicContact CE1-CB 3.54Å; Y584-P687 HydrophobicContact CE1-CG 3.8Å; Y584-P687 HydrophobicContact CE2-CB 4.4Å; Y584-P687 HydrophobicContact CG-CB 4.26Å; Y584-P687 HydrophobicContact CG-CG 4.17Å; P664-P687 HydrophobicContact CG-CB 4.06Å; I685-P687 WeakPolarHBondContact O-CD 3.3Å; P687-Y693 WeakPolarHBondContact CA-OH 3.23Å
688	F	90.3	Very high	92.6	Very high	15 Å²	15	30.8 Å²	30.8	7%	0.066	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	1.9	176.6	-54.4	-67.4	0	0	0	113.1	F573 L580 H581 Y584 W662 W663 N686 F690	F573-F688 HydrophobicContact CE1-CB 4.04Å; F573-F688 HydrophobicContact CE1-CD1 4.5Å; F573-F688 HydrophobicContact CZ-CB 3.85Å; L580-F688 HydrophobicContact CB-CD2 4Å; L580-F688 HydrophobicContact CB-CE1 4.2Å; L580-F688 HydrophobicContact CB-CE2 3.52Å; L580-F688 HydrophobicContact CB-CZ 3.63Å; L580-F688 HydrophobicContact CD1-CD1 4.35Å; L580-F688 HydrophobicContact CD1-CE1 4.49Å; L580-F688 HydrophobicContact CD1-CG 4.42Å; H581-F688 AromaticContact CE1-CD2 3.72Å; H581-F688 AromaticContact ND1-CD2 3.95Å; Y584-F688 HydrophobicContact CG-CZ 4.33Å; W662-F688 HydrophobicContact CE3-CD1 4.29Å; W662-F688 HydrophobicContact CE3-CE1 4.47Å; W662-F688 AromaticContact CZ3-CD1 3.95Å; W662-F688 HydrophobicContact CZ3-CD1 3.95Å; W662-F688 AromaticContact CZ3-CE1 3.86Å; W662-F688 HydrophobicContact CZ3-CE1 3.86Å; W663-F688 AromaticContact CE3-CE1 3.94Å; W663-F688 HydrophobicContact CE3-CE1 3.94Å; W663-F688 HydrophobicContact CE3-CZ 4.41Å; W663-F688 HydrophobicContact CH2-CZ 4.3Å; W663-F688 AromaticContact CZ3-CE1 3.75Å; W663-F688 HydrophobicContact CZ3-CE1 3.75Å; W663-F688 AromaticContact CZ3-CZ 3.8Å; W663-F688 HydrophobicContact CZ3-CZ 3.8Å; N686-F688 PolarHBondContact O-N 3.49Å; N686-F688 PolarHBondContact OD1-N 3.08Å; F688-F690 PolarHBondContact O-N 3.5Å
689	C	91.1	Very high	92.8	Very high	39 Å²	39	30 Å²	30	26%	0.264	16%	0.163	S	C	.	.			trans	-86.6	97.2	171.4	-172.1	0	0	0	0	110.4	N686 E691 S692	N686-C689 HydrophobicContact CB-CB 3.84Å; N686-C689 PolarHBondContact O-N 2.96Å; N686-C689 PolarHBondContact OD1-N 2.96Å; C689-E691 VanDerWaalsContact C-N 3.32Å; C689-E691 PolarHBondContact O-N 2.91Å; C689-S692 PolarHBondContact O-N 3.17Å; C689-S692 PolarHBondContact SG-OG 3.32Å
690	F	92.9	Very high	92.9	Very high	14 Å²	14	29.6 Å²	29.6	6%	0.061	16%	0.162	C	C	.	.	H	α-helix	trans	-58.7	-40.8	179.7	175.6	-104	0	0	0	113.1	A538 A540 V566 L568 F688 S692 Y693 Q694	A538-F690 HydrophobicContact CB-CE1 3.48Å; A538-F690 VanDerWaalsContact CB-CE1 3.48Å; A538-F690 HydrophobicContact CB-CZ 3.51Å; A540-F690 HydrophobicContact CB-CD2 4.49Å; A540-F690 HydrophobicContact CB-CE2 3.83Å; A540-F690 HydrophobicContact CB-CZ 4.27Å; V566-F690 HydrophobicContact CG2-CD2 4.33Å; V566-F690 WeakPolarHBondContact O-CE2 3.47Å; L568-F690 HydrophobicContact CB-CD1 4.13Å; L568-F690 HydrophobicContact CB-CD2 4.4Å; L568-F690 HydrophobicContact CB-CE1 4.35Å; L568-F690 HydrophobicContact CB-CG 4.16Å; L568-F690 HydrophobicContact CD1-CB 3.84Å; L568-F690 HydrophobicContact CD1-CD1 3.57Å; L568-F690 HydrophobicContact CD1-CE1 4.39Å; L568-F690 HydrophobicContact CD1-CG 3.83Å; L568-F690 HydrophobicContact CG-CD1 4.47Å; F688-F690 PolarHBondContact O-N 3.5Å; F690-S692 VanDerWaalsContact C-N 3.26Å; F690-S692 PolarHBondContact O-N 3.1Å; F690-Y693 PolarHBondContact O-N 2.76Å; F690-Y693 VanDerWaalsContact O-N 3.08Å; F690-Q694 HydrophobicContact CD1-CG 4.21Å; F690-Q694 HydrophobicContact CE1-CG 3.67Å; F690-Q694 VanDerWaalsContact CE1-OE1 3.31Å; F690-Q694 HydrophobicContact CE2-CG 4.49Å; F690-Q694 HydrophobicContact CZ-CG 3.81Å; F690-Q694 PolarHBondContact O-N 3.45Å
691	E	92.6	Very high	93.1	Very high	113 Å²	113	29.2 Å²	29.2	53%	0.528	16%	0.16	S	C	.	.	H	α-helix	trans	-60.3	-35	179	-65.5	-172.5	-171.4	0	0	112.7	C689 Y693 Q694 K695	C689-E691 VanDerWaalsContact C-N 3.32Å; C689-E691 PolarHBondContact O-N 2.91Å; E691-Y693 VanDerWaalsContact C-N 3.28Å; E691-Y693 PolarHBondContact O-N 3.49Å; E691-Q694 WeakPolarHBondContact O-CB 3.19Å; E691-Q694 PolarHBondContact O-N 2.86Å; E691-Q694 VanDerWaalsContact O-N 3.15Å; E691-K695 WeakPolarHBondContact O-CB 3.32Å; E691-K695 WeakPolarHBondContact O-CD 3.28Å; E691-K695 VanDerWaalsContact O-CG 3.32Å; E691-K695 WeakPolarHBondContact O-CG 3.36Å; E691-K695 PolarHBondContact O-N 3.49Å; E691-K695 IonicContact OE2-NZ 2.78Å; E691-K695 PolarHBondContact OE2-NZ 3.26Å
692	S	92.8	Very high	93.3	Very high	18 Å²	18	29 Å²	29	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-64.5	-34.9	177.4	-58.1	0	0	0	0	111.5	I685 C689 F690 K695 S696	I685-S692 VanDerWaalsContact CD1-CB 3.5Å; C689-S692 PolarHBondContact O-N 3.17Å; C689-S692 PolarHBondContact SG-OG 3.32Å; F690-S692 VanDerWaalsContact C-N 3.26Å; F690-S692 PolarHBondContact O-N 3.1Å; S692-K695 PolarHBondContact O-N 3.3Å; S692-S696 PolarHBondContact O-N 3.31Å
693	Y	94.9	Very high	93.4	Very high	4 Å²	4	26.8 Å²	26.8	2%	0.016	14%	0.143	C	C	.	.	H	α-helix	trans	-68.2	-39.1	172.1	-68.4	-66.4	0	0	0	112	R542 V566 P664 L680 I685 P687 F690 E691 K695 S696 D697	R542-Y693 HydrophobicContact CG-CD1 3.82Å; R542-Y693 HydrophobicContact CG-CE1 4.44Å; R542-Y693 HydrophobicContact CG-CG 4.32Å; V566-Y693 HydrophobicContact CG2-CD2 3.72Å; V566-Y693 HydrophobicContact CG2-CE2 4.34Å; V566-Y693 HydrophobicContact CG2-CG 3.86Å; P664-Y693 WeakPolarHBondContact CB-OH 3.41Å; L680-Y693 HydrophobicContact CD2-CE1 4.37Å; I685-Y693 HydrophobicContact CD1-CD1 3.73Å; I685-Y693 HydrophobicContact CD1-CE1 3.74Å; I685-Y693 HydrophobicContact CD1-CG 4.14Å; P687-Y693 WeakPolarHBondContact CA-OH 3.23Å; F690-Y693 PolarHBondContact O-N 2.76Å; F690-Y693 VanDerWaalsContact O-N 3.08Å; E691-Y693 VanDerWaalsContact C-N 3.28Å; E691-Y693 PolarHBondContact O-N 3.49Å; Y693-K695 PolarHBondContact O-N 2.92Å; Y693-S696 WeakPolarHBondContact CA-OG 3.37Å; Y693-S696 PolarHBondContact O-N 2.96Å; Y693-S696 VanDerWaalsContact O-N 3.17Å; Y693-S696 PolarHBondContact O-OG 3.49Å; Y693-D697 PolarHBondContact O-N 3.42Å
694	Q	95.7	Very high	93.6	Very high	39 Å²	39	22.3 Å²	22.3	18%	0.182	12%	0.123	C	C	.	.	H	α-helix	trans	-60.4	-45.8	172.6	-60.6	-173.1	-73.8	0	0	111.5	H527 A540 F690 E691 S696 D697 I698	H527-Q694 VanDerWaalsContact CB-NE2 3.32Å; H527-Q694 PolarHBondContact CE1-O 3.01Å; H527-Q694 PolarHBondContact O-NE2 3.3Å; A540-Q694 HydrophobicContact CB-CG 4.04Å; F690-Q694 HydrophobicContact CD1-CG 4.21Å; F690-Q694 HydrophobicContact CE1-CG 3.67Å; F690-Q694 VanDerWaalsContact CE1-OE1 3.31Å; F690-Q694 HydrophobicContact CE2-CG 4.49Å; F690-Q694 HydrophobicContact CZ-CG 3.81Å; F690-Q694 PolarHBondContact O-N 3.45Å; E691-Q694 WeakPolarHBondContact O-CB 3.19Å; E691-Q694 PolarHBondContact O-N 2.86Å; E691-Q694 VanDerWaalsContact O-N 3.15Å; Q694-S696 PolarHBondContact O-N 3.17Å; Q694-D697 WeakPolarHBondContact O-CB 3.49Å; Q694-D697 PolarHBondContact O-N 3.43Å; Q694-D697 VanDerWaalsContact O-N 3.1Å; Q694-I698 WeakPolarHBondContact O-CG1 3.45Å; Q694-I698 PolarHBondContact O-N 2.81Å; Q694-I698 VanDerWaalsContact O-N 3.11Å
695	K	95.3	Very high	93.7	Very high	36 Å²	36	18.2 Å²	18.2	16%	0.157	9%	0.094	C	C	.	.	H	α-helix	trans	-61.9	-28.7	175.8	-70.3	157.8	175.3	167	0	112.4	E691 S692 Y693 Y699 P977 D978 R980	E691-K695 WeakPolarHBondContact O-CB 3.32Å; E691-K695 WeakPolarHBondContact O-CD 3.28Å; E691-K695 VanDerWaalsContact O-CG 3.32Å; E691-K695 WeakPolarHBondContact O-CG 3.36Å; E691-K695 PolarHBondContact O-N 3.49Å; E691-K695 IonicContact OE2-NZ 2.78Å; E691-K695 PolarHBondContact OE2-NZ 3.26Å; S692-K695 PolarHBondContact O-N 3.3Å; Y693-K695 PolarHBondContact O-N 2.92Å; K695-Y699 PolarHBondContact O-N 3.4Å; K695-P977 HydrophobicContact CB-CB 4.12Å; K695-P977 HydrophobicContact CD-CB 4.31Å; K695-P977 VanDerWaalsContact CD-O 3.3Å; K695-P977 WeakPolarHBondContact CD-O 3.45Å; K695-P977 WeakPolarHBondContact CG-O 3.47Å; K695-D978 WeakPolarHBondContact CE-OD1 3.38Å; K695-D978 IonicContact NZ-OD1 2.98Å; K695-D978 PolarHBondContact NZ-OD1 3.25Å; K695-R980 PolarHBondContact O-NH1 3.46Å
696	S	95.1	Very high	93.7	Very high	4 Å²	4	17.8 Å²	17.8	3%	0.028	9%	0.092	C	C	.	.	H	α-helix	trans	-74.3	-36.1	171.9	79.7	0	0	0	0	113.3	S692 Y693 Q694 I698 Y699 A700	S692-S696 PolarHBondContact O-N 3.31Å; Y693-S696 WeakPolarHBondContact CA-OG 3.37Å; Y693-S696 PolarHBondContact O-N 2.96Å; Y693-S696 VanDerWaalsContact O-N 3.17Å; Y693-S696 PolarHBondContact O-OG 3.49Å; Q694-S696 PolarHBondContact O-N 3.17Å; S696-I698 VanDerWaalsContact C-N 3.29Å; S696-I698 PolarHBondContact O-N 3.1Å; S696-Y699 WeakPolarHBondContact O-CB 3.45Å; S696-Y699 PolarHBondContact O-N 3.15Å; S696-A700 PolarHBondContact O-N 3.19Å
697	D	96.9	Very high	93.5	Very high	1 Å²	1	15 Å²	15	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-65.2	-33.3	172.6	-64.9	-31.1	0	0	0	111.8	L523 H527 A540 H541 R542 Y693 Q694 A700 L701	L523-D697 HydrophobicContact CD1-CB 4.07Å; L523-D697 HydrophobicContact CD2-CB 4.23Å; H527-D697 IonicContact CD2-OD2 3.4Å; H527-D697 IonicContact CE1-OD2 3.51Å; H527-D697 IonicContact NE2-OD2 2.72Å; H527-D697 PolarHBondContact NE2-OD2 2.91Å; A540-D697 VanDerWaalsContact CA-OD2 3.27Å; A540-D697 WeakPolarHBondContact CA-OD2 3.46Å; H541-D697 WeakPolarHBondContact CB-OD1 3.38Å; H541-D697 VanDerWaalsContact N-CG 3.33Å; H541-D697 PolarHBondContact N-OD1 3.15Å; H541-D697 PolarHBondContact N-OD2 3.36Å; R542-D697 PolarHBondContact N-OD1 3.49Å; Y693-D697 PolarHBondContact O-N 3.42Å; Q694-D697 WeakPolarHBondContact O-CB 3.49Å; Q694-D697 PolarHBondContact O-N 3.43Å; Q694-D697 VanDerWaalsContact O-N 3.1Å; D697-A700 PolarHBondContact O-N 2.86Å; D697-L701 VanDerWaalsContact O-CB 3.31Å; D697-L701 WeakPolarHBondContact O-CB 3.45Å; D697-L701 PolarHBondContact O-N 3.39Å
698	I	97	Very high	93.5	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-65.1	-41	176.3	-62.4	-60.8	0	0	0	111.4	L523 Q694 S696 L701 A702 C972 R980 L981 A983 I986	L523-I698 HydrophobicContact CD2-CD1 4.13Å; Q694-I698 WeakPolarHBondContact O-CG1 3.45Å; Q694-I698 PolarHBondContact O-N 2.81Å; Q694-I698 VanDerWaalsContact O-N 3.11Å; S696-I698 VanDerWaalsContact C-N 3.29Å; S696-I698 PolarHBondContact O-N 3.1Å; I698-L701 HydrophobicContact CD1-CD2 4.43Å; I698-L701 WeakPolarHBondContact O-CB 3.49Å; I698-L701 PolarHBondContact O-N 3.09Å; I698-A702 PolarHBondContact O-N 3.11Å; I698-C972 HydrophobicContact CG2-CB 4.01Å; I698-R980 HydrophobicContact CG2-CB 4.36Å; I698-L981 WeakPolarHBondContact CD1-O 3.38Å; I698-L981 WeakPolarHBondContact CG1-O 3.37Å; I698-L981 VanDerWaalsContact CG2-O 3.24Å; I698-L981 WeakPolarHBondContact CG2-O 3.5Å; I698-A983 HydrophobicContact CD1-CB 3.91Å; I698-I986 HydrophobicContact CD1-CD1 4.05Å; I698-I986 HydrophobicContact CG2-CD1 4.01Å
699	Y	96	Very high	93.4	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.4	-46.8	174	175	-85.1	0	0	0	111	M676 A677 P678 K695 S696 A702 L703 V850 W973	M676-Y699 VanDerWaalsContact O-CE1 3.24Å; M676-Y699 WeakPolarHBondContact O-CE1 3.44Å; A677-Y699 VanDerWaalsContact CA-CD1 3.43Å; A677-Y699 HydrophobicContact CB-CD1 3.84Å; A677-Y699 HydrophobicContact CB-CD2 4.38Å; A677-Y699 HydrophobicContact CB-CG 3.74Å; P678-Y699 HydrophobicContact CG-CE2 4.37Å; K695-Y699 PolarHBondContact O-N 3.4Å; S696-Y699 WeakPolarHBondContact O-CB 3.45Å; S696-Y699 PolarHBondContact O-N 3.15Å; Y699-A702 WeakPolarHBondContact O-CB 3.35Å; Y699-A702 PolarHBondContact O-N 3.5Å; Y699-L703 HydrophobicContact CD1-CD1 4.14Å; Y699-L703 HydrophobicContact CE1-CD1 3.54Å; Y699-L703 HydrophobicContact CE1-CG 4.31Å; Y699-L703 PolarHBondContact O-N 3.02Å; Y699-V850 WeakPolarHBondContact OH-CG1 3.36Å; Y699-W973 HydrophobicContact CD2-CB 3.58Å; Y699-W973 HydrophobicContact CE2-CB 3.82Å
700	A	94.9	Very high	93	Very high	4 Å²	4	12.6 Å²	12.6	3%	0.033	6%	0.062	C	C	.	.	H	α-helix	trans	-62.5	-42.8	176.7	0	0	0	0	0	112.3	L544 S696 D697 A702 L703 I704	L544-A700 HydrophobicContact CB-CB 4.03Å; S696-A700 PolarHBondContact O-N 3.19Å; D697-A700 PolarHBondContact O-N 2.86Å; A700-A702 VanDerWaalsContact C-N 3.32Å; A700-A702 PolarHBondContact O-N 3.37Å; A700-L703 PolarHBondContact O-N 2.71Å; A700-I704 WeakPolarHBondContact O-CD1 3.32Å; A700-I704 VanDerWaalsContact O-CG1 3.29Å; A700-I704 WeakPolarHBondContact O-CG1 3.44Å; A700-I704 PolarHBondContact O-N 2.9Å
701	L	96.5	Very high	92.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-56.4	-44.9	173.6	171.2	66.7	0	0	0	111.4	L519 V520 L523 L544 D697 I698 L703 I704 L705 I986	L519-L701 HydrophobicContact CD2-CD1 3.58Å; L519-L701 HydrophobicContact CG-CD1 3.74Å; V520-L701 HydrophobicContact CG2-CD1 4.12Å; V520-L701 HydrophobicContact CG2-CD2 4.06Å; L523-L701 HydrophobicContact CD2-CB 4.09Å; L523-L701 HydrophobicContact CD2-CD2 3.78Å; L523-L701 HydrophobicContact CD2-CG 4.41Å; L544-L701 HydrophobicContact CD2-CB 4.01Å; D697-L701 VanDerWaalsContact O-CB 3.31Å; D697-L701 WeakPolarHBondContact O-CB 3.45Å; D697-L701 PolarHBondContact O-N 3.39Å; I698-L701 HydrophobicContact CD1-CD2 4.43Å; I698-L701 WeakPolarHBondContact O-CB 3.49Å; I698-L701 PolarHBondContact O-N 3.09Å; L701-L703 VanDerWaalsContact C-N 3.33Å; L701-L703 PolarHBondContact O-N 2.9Å; L701-I704 PolarHBondContact O-N 3.22Å; L701-I704 VanDerWaalsContact O-N 3.17Å; L701-L705 HydrophobicContact CD1-CD1 4.16Å; L701-L705 HydrophobicContact CD1-CD2 4.19Å; L701-L705 HydrophobicContact CD1-CG 3.92Å; L701-L705 HydrophobicContact CD2-CD1 4.48Å; L701-L705 HydrophobicContact CG-CD1 3.96Å; L701-L705 HydrophobicContact CG-CG 4.14Å; L701-L705 VanDerWaalsContact O-CG 3.3Å; L701-L705 WeakPolarHBondContact O-CG 3.33Å; L701-L705 PolarHBondContact O-N 2.75Å; L701-I986 HydrophobicContact CD2-CD1 3.79Å
702	A	94.1	Very high	92.2	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-60.6	-41.3	-178.7	0	0	0	0	0	112.6	I698 Y699 A700 L705 W706 L969 C972 W973	I698-A702 PolarHBondContact O-N 3.11Å; Y699-A702 WeakPolarHBondContact O-CB 3.35Å; Y699-A702 PolarHBondContact O-N 3.5Å; A700-A702 VanDerWaalsContact C-N 3.32Å; A700-A702 PolarHBondContact O-N 3.37Å; A702-L705 PolarHBondContact O-N 3.18Å; A702-W706 WeakPolarHBondContact O-CB 3.46Å; A702-W706 PolarHBondContact O-N 2.69Å; A702-L969 HydrophobicContact CB-CD2 4.21Å; A702-L969 WeakPolarHBondContact O-CD2 3.39Å; A702-C972 HydrophobicContact CB-CB 3.51Å; A702-W973 HydrophobicContact CB-CB 4.31Å; A702-W973 HydrophobicContact CB-CD2 4.16Å; A702-W973 HydrophobicContact CB-CE3 3.46Å; A702-W973 VanDerWaalsContact CB-CE3 3.46Å; A702-W973 HydrophobicContact CB-CZ3 4.08Å
703	L	92.5	Very high	91.6	Very high	4 Å²	4	6.5 Å²	6.5	2%	0.021	3%	0.031	C	C	.	.	H	α-helix	trans	-62	-44.3	174.3	-64	174.4	0	0	0	111.7	Y675 Y699 A700 L701 W706 E707 P857 W973	Y675-L703 HydrophobicContact CD1-CB 4.04Å; Y675-L703 HydrophobicContact CD1-CD1 4.07Å; Y675-L703 HydrophobicContact CE1-CB 4.21Å; Y699-L703 HydrophobicContact CD1-CD1 4.14Å; Y699-L703 HydrophobicContact CE1-CD1 3.54Å; Y699-L703 HydrophobicContact CE1-CG 4.31Å; Y699-L703 PolarHBondContact O-N 3.02Å; A700-L703 PolarHBondContact O-N 2.71Å; L701-L703 VanDerWaalsContact C-N 3.33Å; L701-L703 PolarHBondContact O-N 2.9Å; L703-W706 WeakPolarHBondContact O-CB 3.45Å; L703-W706 PolarHBondContact O-N 3.17Å; L703-E707 PolarHBondContact O-N 3.43Å; L703-P857 HydrophobicContact CD2-CG 3.76Å; L703-W973 HydrophobicContact CD2-CE3 4.13Å; L703-W973 HydrophobicContact CD2-CZ3 4.32Å
704	I	93.7	Very high	90.5	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-65.8	-42.9	179	-61.3	161.6	0	0	0	111	L462 L519 L544 P546 I549 Y675 A700 L701 W706 E707 V708	L462-I704 HydrophobicContact CD2-CG2 3.71Å; L519-I704 HydrophobicContact CD2-CB 4.47Å; L519-I704 HydrophobicContact CD2-CG2 3.73Å; L544-I704 HydrophobicContact CD2-CD1 4.18Å; L544-I704 HydrophobicContact CG-CD1 3.8Å; P546-I704 HydrophobicContact CG-CG1 4.19Å; I549-I704 HydrophobicContact CD1-CD1 3.82Å; I549-I704 HydrophobicContact CD1-CG2 3.92Å; Y675-I704 HydrophobicContact CD1-CG1 4.18Å; Y675-I704 HydrophobicContact CE1-CG1 3.96Å; A700-I704 WeakPolarHBondContact O-CD1 3.32Å; A700-I704 VanDerWaalsContact O-CG1 3.29Å; A700-I704 WeakPolarHBondContact O-CG1 3.44Å; A700-I704 PolarHBondContact O-N 2.9Å; L701-I704 PolarHBondContact O-N 3.22Å; L701-I704 VanDerWaalsContact O-N 3.17Å; I704-W706 VanDerWaalsContact C-N 3.29Å; I704-W706 PolarHBondContact O-N 3.32Å; I704-E707 PolarHBondContact O-N 2.93Å; I704-V708 WeakPolarHBondContact O-CG2 3.43Å; I704-V708 PolarHBondContact O-N 2.97Å; I704-V708 VanDerWaalsContact O-N 3.09Å
705	L	93.9	Very high	89.1	Confident	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.037	C	C	.	.	H	α-helix	trans	-59.1	-42.9	174.6	-69	177.3	0	0	0	110.8	T516 V520 L701 A702 V708 V709 F965 L969 I986	T516-L705 HydrophobicContact CG2-CD2 3.55Å; V520-L705 HydrophobicContact CG2-CD2 4.41Å; L701-L705 HydrophobicContact CD1-CD1 4.16Å; L701-L705 HydrophobicContact CD1-CD2 4.19Å; L701-L705 HydrophobicContact CD1-CG 3.92Å; L701-L705 HydrophobicContact CD2-CD1 4.48Å; L701-L705 HydrophobicContact CG-CD1 3.96Å; L701-L705 HydrophobicContact CG-CG 4.14Å; L701-L705 VanDerWaalsContact O-CG 3.3Å; L701-L705 WeakPolarHBondContact O-CG 3.33Å; L701-L705 PolarHBondContact O-N 2.75Å; A702-L705 PolarHBondContact O-N 3.18Å; L705-V708 PolarHBondContact O-N 2.81Å; L705-V709 VanDerWaalsContact O-CG2 3.24Å; L705-V709 WeakPolarHBondContact O-CG2 3.21Å; L705-V709 PolarHBondContact O-N 3.01Å; L705-F965 HydrophobicContact CB-CE1 4.26Å; L705-F965 HydrophobicContact CD1-CE1 4.43Å; L705-F965 HydrophobicContact CD2-CE1 4.38Å; L705-L969 HydrophobicContact CB-CD2 3.81Å; L705-L969 HydrophobicContact CD1-CD2 4.2Å; L705-I986 HydrophobicContact CD1-CG2 4.46Å
706	W	90.4	Very high	87.5	Confident	2 Å²	2	8.4 Å²	8.4	1%	0.008	5%	0.046	C	C	.	.	H	α-helix	trans	-62.3	-41.5	176.1	179.1	89	0	0	0	112.6	A702 L703 I704 V709 N710 W718 S744 M745 P857 R858 L969 W973	A702-W706 WeakPolarHBondContact O-CB 3.46Å; A702-W706 PolarHBondContact O-N 2.69Å; L703-W706 WeakPolarHBondContact O-CB 3.45Å; L703-W706 PolarHBondContact O-N 3.17Å; I704-W706 VanDerWaalsContact C-N 3.29Å; I704-W706 PolarHBondContact O-N 3.32Å; W706-V709 PolarHBondContact O-N 3.11Å; W706-N710 HydrophobicContact CH2-CB 4.35Å; W706-N710 HydrophobicContact CZ2-CB 4.28Å; W706-N710 WeakPolarHBondContact O-CB 3.21Å; W706-N710 PolarHBondContact O-N 3.19Å; W706-W718 HydrophobicContact CZ2-CH2 4.2Å; W706-W718 HydrophobicContact CZ2-CZ3 4.4Å; W706-W718 AromaticContact NE1-CH2 3.85Å; W706-S744 WeakPolarHBondContact CH2-O 3.01Å; W706-S744 WeakPolarHBondContact CZ3-O 3.45Å; W706-M745 HydrophobicContact CZ3-CG 4.41Å; W706-P857 HydrophobicContact CD2-CB 3.49Å; W706-P857 VanDerWaalsContact CD2-CB 3.49Å; W706-P857 HydrophobicContact CD2-CG 4.19Å; W706-P857 HydrophobicContact CE3-CB 4.1Å; W706-P857 HydrophobicContact CE3-CG 4.35Å; W706-P857 HydrophobicContact CG-CB 3.66Å; W706-P857 HydrophobicContact CG-CG 4.49Å; W706-P857 HydrophobicContact CZ2-CB 4.15Å; W706-R858 PolarHBondContact NE1-O 3.3Å; W706-L969 HydrophobicContact CB-CD1 3.98Å; W706-W973 HydrophobicContact CB-CH2 4.16Å; W706-W973 HydrophobicContact CB-CZ3 4.01Å; W706-W973 HydrophobicContact CG-CH2 4.28Å; W706-W973 HydrophobicContact CG-CZ3 4.48Å
707	E	87.3	Confident	86.1	Confident	8 Å²	8	8.7 Å²	8.7	4%	0.037	5%	0.047	C	C	.	.	H	α-helix	trans	-60.5	-46.7	175.4	-75.8	174	-105.4	0	0	112.2	L466 Y675 L703 I704 V709 N710 W711	L466-E707 HydrophobicContact CD1-CB 4.27Å; Y675-E707 VanDerWaalsContact CE1-OE1 3.29Å; Y675-E707 WeakPolarHBondContact CE1-OE1 3.45Å; Y675-E707 PolarHBondContact OH-OE1 3.49Å; L703-E707 PolarHBondContact O-N 3.43Å; I704-E707 PolarHBondContact O-N 2.93Å; E707-V709 VanDerWaalsContact C-N 3.34Å; E707-V709 PolarHBondContact O-N 2.85Å; E707-N710 PolarHBondContact O-N 3.08Å; E707-W711 WeakPolarHBondContact O-CB 3.49Å; E707-W711 PolarHBondContact O-N 3.07Å
708	V	89.7	Confident	84.5	Confident	1 Å²	1	9.2 Å²	9.2	1%	0.006	5%	0.049	C	C	.	.	H	α-helix	trans	-65.8	-38	179	-173.3	0	0	0	0	111	L462 L466 L512 I515 T516 I704 L705 W711 A712	L462-V708 HydrophobicContact CD1-CG2 4.23Å; L462-V708 HydrophobicContact CD2-CG2 4.01Å; L466-V708 HydrophobicContact CD1-CG2 4.17Å; L466-V708 HydrophobicContact CD2-CG2 4.34Å; L512-V708 HydrophobicContact CD1-CB 4.18Å; L512-V708 HydrophobicContact CD1-CG1 3.63Å; I515-V708 HydrophobicContact CB-CG1 4.4Å; I515-V708 HydrophobicContact CD1-CG1 4.48Å; I515-V708 HydrophobicContact CG2-CG1 4.15Å; I515-V708 HydrophobicContact CG2-CG2 4.09Å; T516-V708 HydrophobicContact CG2-CG1 4.47Å; I704-V708 WeakPolarHBondContact O-CG2 3.43Å; I704-V708 PolarHBondContact O-N 2.97Å; I704-V708 VanDerWaalsContact O-N 3.09Å; L705-V708 PolarHBondContact O-N 2.81Å; V708-W711 HydrophobicContact CG1-CE3 4.37Å; V708-W711 PolarHBondContact O-N 3.32Å; V708-A712 WeakPolarHBondContact O-CB 3.42Å; V708-A712 PolarHBondContact O-N 3.16Å
709	V	88	Confident	82.2	Confident	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-64.6	-47.1	175.3	171.9	0	0	0	0	111.6	L512 L705 W706 E707 W711 A712 L713 I859 F965	L512-V709 HydrophobicContact CD1-CB 4.44Å; L512-V709 HydrophobicContact CD1-CG2 3.75Å; L705-V709 VanDerWaalsContact O-CG2 3.24Å; L705-V709 WeakPolarHBondContact O-CG2 3.21Å; L705-V709 PolarHBondContact O-N 3.01Å; W706-V709 PolarHBondContact O-N 3.11Å; E707-V709 VanDerWaalsContact C-N 3.34Å; E707-V709 PolarHBondContact O-N 2.85Å; V709-W711 VanDerWaalsContact C-N 3.29Å; V709-W711 PolarHBondContact O-N 3.46Å; V709-A712 PolarHBondContact O-N 3.13Å; V709-L713 HydrophobicContact CG1-CD1 3.54Å; V709-L713 HydrophobicContact CG1-CG 4.08Å; V709-L713 WeakPolarHBondContact O-CB 3.33Å; V709-L713 WeakPolarHBondContact O-CG 3.4Å; V709-L713 PolarHBondContact O-N 2.77Å; V709-I859 HydrophobicContact CB-CD1 4.48Å; V709-I859 HydrophobicContact CG1-CD1 3.77Å; V709-I859 HydrophobicContact CG1-CG1 4.39Å; V709-F965 HydrophobicContact CG2-CB 4.23Å; V709-F965 HydrophobicContact CG2-CD1 3.79Å; V709-F965 HydrophobicContact CG2-CD2 3.69Å; V709-F965 HydrophobicContact CG2-CE1 4Å; V709-F965 HydrophobicContact CG2-CE2 3.91Å; V709-F965 HydrophobicContact CG2-CG 3.64Å; V709-F965 HydrophobicContact CG2-CZ 4.07Å
710	N	83	Confident	79.8	Confident	11 Å²	11	14.6 Å²	14.6	6%	0.059	10%	0.095	C	C	.	.	H	α-helix	trans	-66.1	-28.7	177.7	164.8	94.7	0	0	0	112.8	W706 E707 W718 R739 S744	W706-N710 HydrophobicContact CH2-CB 4.35Å; W706-N710 HydrophobicContact CZ2-CB 4.28Å; W706-N710 WeakPolarHBondContact O-CB 3.21Å; W706-N710 PolarHBondContact O-N 3.19Å; E707-N710 PolarHBondContact O-N 3.08Å; N710-W718 HydrophobicContact CB-CH2 4.1Å; N710-W718 HydrophobicContact CB-CZ2 3.89Å; N710-R739 PolarHBondContact OD1-NH1 3.45Å; N710-S744 WeakPolarHBondContact ND2-CB 3.23Å; N710-S744 PolarHBondContact ND2-OG 2.94Å
711	W	84.1	Confident	77.2	Confident	14 Å²	14	16.5 Å²	16.5	5%	0.053	10%	0.104	C	C	.	.	H	α-helix	trans	-71.8	-43.2	172	165.5	88	0	0	0	112.6	F465 L466 W471 R508 I511 E707 V708 V709	F465-W711 AromaticContact CE1-CH2 3.78Å; F465-W711 HydrophobicContact CE1-CH2 3.78Å; F465-W711 AromaticContact CE1-CZ2 3.81Å; F465-W711 HydrophobicContact CE1-CZ2 3.81Å; F465-W711 HydrophobicContact CE1-CZ3 4.19Å; F465-W711 HydrophobicContact CZ-CH2 4.33Å; L466-W711 HydrophobicContact CD2-CB 3.64Å; L466-W711 HydrophobicContact CD2-CD2 3.65Å; L466-W711 HydrophobicContact CD2-CE3 4.04Å; L466-W711 HydrophobicContact CD2-CG 3.42Å; L466-W711 VanDerWaalsContact CD2-CG 3.42Å; W471-W711 AromaticContact CD1-CZ2 3.66Å; W471-W711 AromaticContact CD1-NE1 3.76Å; W471-W711 AromaticContact CD2-CZ2 3.75Å; W471-W711 HydrophobicContact CD2-CZ2 3.75Å; W471-W711 AromaticContact CE2-CZ2 3.57Å; W471-W711 AromaticContact CG-CZ2 3.89Å; W471-W711 HydrophobicContact CG-CZ2 3.89Å; W471-W711 HydrophobicContact CZ2-CZ2 4.3Å; W471-W711 AromaticContact NE1-CE2 3.7Å; W471-W711 AromaticContact NE1-CZ2 3.44Å; W471-W711 AromaticContact NE1-NE1 3.39Å; R508-W711 HydrophobicContact CG-CH2 4.21Å; I511-W711 HydrophobicContact CB-CH2 4.25Å; I511-W711 HydrophobicContact CB-CZ3 4.37Å; I511-W711 HydrophobicContact CD1-CH2 4.36Å; I511-W711 HydrophobicContact CG2-CH2 3.73Å; I511-W711 HydrophobicContact CG2-CZ3 3.81Å; E707-W711 WeakPolarHBondContact O-CB 3.49Å; E707-W711 PolarHBondContact O-N 3.07Å; V708-W711 HydrophobicContact CG1-CE3 4.37Å; V708-W711 PolarHBondContact O-N 3.32Å; V709-W711 VanDerWaalsContact C-N 3.29Å; V709-W711 PolarHBondContact O-N 3.46Å
712	A	83.7	Confident	74.2	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-78.3	-42.2	-173.1	0	0	0	0	0	113.9	R508 L512 V708 V709	R508-A712 HydrophobicContact CB-CB 4.47Å; L512-A712 HydrophobicContact CB-CB 3.7Å; L512-A712 HydrophobicContact CD1-CB 4.35Å; L512-A712 HydrophobicContact CD2-CB 3.91Å; L512-A712 HydrophobicContact CG-CB 4.19Å; V708-A712 WeakPolarHBondContact O-CB 3.42Å; V708-A712 PolarHBondContact O-N 3.16Å; V709-A712 PolarHBondContact O-N 3.13Å
713	L	80.2	Confident	71.4	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.016	18%	0.176	C	C	.	.	S	Bend	trans	-73.6	145.6	-175.8	-66.1	-177	0	0	0	111.9	L509 V709 I717 Q958 A962	L509-L713 HydrophobicContact CD2-CD2 3.89Å; V709-L713 HydrophobicContact CG1-CD1 3.54Å; V709-L713 HydrophobicContact CG1-CG 4.08Å; V709-L713 WeakPolarHBondContact O-CB 3.33Å; V709-L713 WeakPolarHBondContact O-CG 3.4Å; V709-L713 PolarHBondContact O-N 2.77Å; L713-I717 HydrophobicContact CB-CD1 4.39Å; L713-I717 HydrophobicContact CD1-CD1 4.49Å; L713-I717 HydrophobicContact CD2-CD1 4.24Å; L713-Q958 HydrophobicContact CD2-CB 3.99Å; L713-Q958 HydrophobicContact CD2-CG 4.32Å; L713-A962 HydrophobicContact CD1-CB 3.76Å
714	P	71.6	Confident	68.3	Low	7 Å²	7	35 Å²	35	5%	0.045	20%	0.199	C	C	.	.			trans	-68.9	155.1	175.3	30.8	-37.2	0	0	0	112.2	S716 I717	P714-S716 WeakPolarHBondContact CB-OG 3.03Å; P714-S716 WeakPolarHBondContact CG-OG 3.31Å; P714-S716 PolarHBondContact O-N 3.11Å; P714-I717 HydrophobicContact CG-CD1 3.96Å; P714-I717 HydrophobicContact CG-CG1 4.24Å; P714-I717 PolarHBondContact O-N 3.36Å
715	K	66.2	Low	65.4	Low	61 Å²	61	41 Å²	41	27%	0.265	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60.7	-26.5	179.2	-65.5	-177.5	-177.3	176.1	0	113.2	I717 W718 R737	K715-I717 PolarHBondContact O-N 2.87Å; K715-I717 VanDerWaalsContact O-N 3.17Å; K715-W718 WeakPolarHBondContact O-CB 3.44Å; K715-W718 PolarHBondContact O-N 2.92Å; K715-R737 PolarHBondContact NZ-O 3.44Å
716	S	62.9	Low	62.5	Low	51 Å²	51	46 Å²	46	36%	0.357	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-57	-25.8	177.3	42.3	0	0	0	0	114.3	P714 W718 Y923	P714-S716 WeakPolarHBondContact CB-OG 3.03Å; P714-S716 WeakPolarHBondContact CG-OG 3.31Å; P714-S716 PolarHBondContact O-N 3.11Å; S716-W718 PolarHBondContact O-N 2.98Å; S716-Y923 PolarHBondContact OG-OH 3.27Å
717	I	66.3	Low	59.8	Low	9 Å²	9	53.5 Å²	53.5	5%	0.046	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-77.1	-7.3	176.9	-64.4	173.6	0	0	0	111.7	L713 P714 K715 Q958 Y959 A962	L713-I717 HydrophobicContact CB-CD1 4.39Å; L713-I717 HydrophobicContact CD1-CD1 4.49Å; L713-I717 HydrophobicContact CD2-CD1 4.24Å; P714-I717 HydrophobicContact CG-CD1 3.96Å; P714-I717 HydrophobicContact CG-CG1 4.24Å; P714-I717 PolarHBondContact O-N 3.36Å; K715-I717 PolarHBondContact O-N 2.87Å; K715-I717 VanDerWaalsContact O-N 3.17Å; I717-Q958 HydrophobicContact CD1-CB 3.52Å; I717-Q958 HydrophobicContact CD1-CG 4.48Å; I717-Y959 HydrophobicContact CG1-CD1 4.34Å; I717-Y959 HydrophobicContact CG1-CE1 4.08Å; I717-A962 HydrophobicContact CG2-CB 4.04Å
718	W	63.1	Low	57.3	Low	12 Å²	12	57.1 Å²	57.1	5%	0.045	33%	0.328	C	S	.	.	S	Bend	trans	-110.9	103.7	-176.1	-57.1	74.1	0	0	0	110.2	W706 N710 K715 S716 I859 P860	W706-W718 HydrophobicContact CZ2-CH2 4.2Å; W706-W718 HydrophobicContact CZ2-CZ3 4.4Å; W706-W718 AromaticContact NE1-CH2 3.85Å; N710-W718 HydrophobicContact CB-CH2 4.1Å; N710-W718 HydrophobicContact CB-CZ2 3.89Å; K715-W718 WeakPolarHBondContact O-CB 3.44Å; K715-W718 PolarHBondContact O-N 2.92Å; S716-W718 PolarHBondContact O-N 2.98Å; W718-I859 HydrophobicContact CH2-CG1 4.46Å; W718-P860 HydrophobicContact CB-CG 4.35Å; W718-P860 HydrophobicContact CD2-CG 3.89Å; W718-P860 HydrophobicContact CE3-CG 3.43Å; W718-P860 VanDerWaalsContact CE3-CG 3.43Å; W718-P860 HydrophobicContact CG-CG 4.31Å; W718-P860 HydrophobicContact CZ3-CG 3.99Å
719	P	48.4	Very low	54.4	Low	55 Å²	55	60.9 Å²	60.9	36%	0.357	35%	0.347	S	S	.	.	S	Bend	trans	-65	156.5	-176.9	-10.7	21.3	0	0	0	112.8	T748 P860 S862	P719-T748 WeakPolarHBondContact O-CG2 3.09Å; P719-P860 HydrophobicContact CG-CB 4.08Å; P719-S862 WeakPolarHBondContact CG-OG 3.38Å
720	G	44.5	Very low	51.5	Low	62 Å²	62	65.4 Å²	65.4	64%	0.639	38%	0.377	S	S	*	.			trans	85.4	28.8	172.2	0	0	0	0	0	115.4	Y763	G720-Y763 PolarHBondContact O-OH 3.49Å
721	Q	40.8	Very low	49	Very low	45 Å²	45	72 Å²	72	21%	0.21	41%	0.413	C	S	.	.			trans	-109.5	92.1	165.5	-59.9	-148.8	-56.2	0	0	110.2	F723	Q721-F723 WeakPolarHBondContact O-CD2 3.23Å; Q721-F723 PolarHBondContact O-N 3Å
722	D	33.6	Very low	46.5	Very low	153 Å²	153	79.1 Å²	79.1	82%	0.818	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-65.5	121.3	168.9	-62.5	-37.9	0	0	0	109
723	F	34.5	Very low	43.8	Very low	160 Å²	160	83.1 Å²	83.1	70%	0.702	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-88.4	130.2	174.9	-78.3	-93.7	0	0	0	110.3	Q721	Q721-F723 WeakPolarHBondContact O-CD2 3.23Å; Q721-F723 PolarHBondContact O-N 3Å
724	P	29.3	Very low	41.2	Very low	78 Å²	78	87.9 Å²	87.9	51%	0.506	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-67.6	149.2	162.8	30.1	-33	0	0	0	110	V726	P724-V726 PolarHBondContact O-N 2.72Å
725	D	31	Very low	39.2	Very low	127 Å²	127	93.1 Å²	93.1	68%	0.679	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-48.1	127.5	-173.1	-90.9	-48.8	0	0	0	113.4	N727 S728	D725-N727 PolarHBondContact O-N 2.85Å; D725-S728 WeakPolarHBondContact O-CB 3.27Å; D725-S728 PolarHBondContact O-N 2.84Å; D725-S728 PolarHBondContact O-OG 2.92Å
726	V	35	Very low	37.4	Very low	106 Å²	106	94.1 Å²	94.1	64%	0.642	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-55.3	-26.1	-179	-179.4	0	0	0	0	112.2	P724 S728	P724-V726 PolarHBondContact O-N 2.72Å; V726-S728 VanDerWaalsContact C-N 3.26Å; V726-S728 PolarHBondContact O-N 2.71Å
727	N	33.3	Very low	36	Very low	159 Å²	159	102.9 Å²	102.9	85%	0.85	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-75	-6.6	179.7	-59.9	-29.7	0	0	0	114.5	D725	D725-N727 PolarHBondContact O-N 2.85Å
728	S	34	Very low	34.8	Very low	84 Å²	84	105 Å²	105	59%	0.587	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-99.7	-0.6	-178.4	66.7	0	0	0	0	114.4	D725 V726	D725-S728 WeakPolarHBondContact O-CB 3.27Å; D725-S728 PolarHBondContact O-N 2.84Å; D725-S728 PolarHBondContact O-OG 2.92Å; V726-S728 VanDerWaalsContact C-N 3.26Å; V726-S728 PolarHBondContact O-N 2.71Å
729	I	30	Very low	34	Very low	80 Å²	80	106.7 Å²	106.7	41%	0.41	59%	0.593	S	S	.	*	S	Bend	trans	-102.2	127.8	-171	-62.4	175.9	0	0	0	109.3	N731 C733	I729-N731 PolarHBondContact O-N 2.9Å; I729-C733 HydrophobicContact CG2-CB 3.38Å
730	P	26.7	Very low	33.6	Very low	95 Å²	95	105.2 Å²	105.2	62%	0.617	58%	0.584	S	S	*	*			trans	-57.3	139	173.9	-24	33.8	0	0	0	111.6	D732 C733	P730-D732 PolarHBondContact O-N 3.35Å; P730-C733 WeakPolarHBondContact O-CB 3.46Å; P730-C733 PolarHBondContact O-N 2.78Å
731	N	30	Very low	33.4	Very low	151 Å²	151	103.1 Å²	103.1	81%	0.807	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-56.1	-22	-172.3	-76.1	-29.4	0	0	0	114.7	I729 C733 S734	I729-N731 PolarHBondContact O-N 2.9Å; N731-C733 PolarHBondContact O-N 2.91Å; N731-S734 WeakPolarHBondContact O-CB 3.5Å; N731-S734 PolarHBondContact O-OG 2.81Å
732	D	31.4	Very low	33.5	Very low	162 Å²	162	104.5 Å²	104.5	87%	0.866	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-71.8	-5.6	175	-63.3	-29.6	0	0	0	114.5	P730	P730-D732 PolarHBondContact O-N 3.35Å
733	C	26.6	Very low	34	Very low	86 Å²	86	101.1 Å²	101.1	58%	0.581	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-95.1	12	177.3	-80.9	0	0	0	0	114.1	I729 P730 N731 L735	I729-C733 HydrophobicContact CG2-CB 3.38Å; P730-C733 WeakPolarHBondContact O-CB 3.46Å; P730-C733 PolarHBondContact O-N 2.78Å; N731-C733 PolarHBondContact O-N 2.91Å; C733-L735 PolarHBondContact O-N 2.88Å
734	S	25.6	Very low	34.4	Very low	103 Å²	103	93.6 Å²	93.6	72%	0.72	52%	0.52	S	S	*	.			trans	-77.6	35.6	-172	67.8	0	0	0	0	115.9	N731	N731-S734 WeakPolarHBondContact O-CB 3.5Å; N731-S734 PolarHBondContact O-OG 2.81Å
735	L	30.1	Very low	35	Very low	117 Å²	117	90.5 Å²	90.5	61%	0.613	50%	0.498	S	S	*	.	S	Bend	trans	-148.7	94.8	169.6	-104	158.7	0	0	0	109.3	N472 C733 R737	N472-L735 WeakPolarHBondContact ND2-CD2 3.43Å; C733-L735 PolarHBondContact O-N 2.88Å; L735-R737 PolarHBondContact O-N 2.99Å
736	S	28.4	Very low	35.3	Very low	81 Å²	81	85.1 Å²	85.1	57%	0.566	47%	0.471	S	S	*	.			trans	-58.8	115.3	-170.6	71.8	0	0	0	0	111.7	R738	S736-R738 PolarHBondContact O-N 3.17Å
737	R	32.9	Very low	35.4	Very low	235 Å²	235	81.5 Å²	81.5	89%	0.887	45%	0.448	S	S	*	.			trans	-55.9	97.9	172.4	-161	175.2	-72.6	-177	-1.8	108.2	K715 L735	K715-R737 PolarHBondContact NZ-O 3.44Å; L735-R737 PolarHBondContact O-N 2.99Å
738	R	41.6	Very low	35.4	Very low	55 Å²	55	76.8 Å²	76.8	21%	0.208	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-72.2	148.2	171.5	-68	-164.4	-171.7	174.4	9.5	107.5	D505 S736 S740	D505-R738 IonicContact OD1-CZ 3.76Å; D505-R738 VanDerWaalsContact OD1-CZ 3.3Å; D505-R738 IonicContact OD1-NH1 3.55Å; D505-R738 PolarHBondContact OD1-NH1 2.62Å; D505-R738 IonicContact OD1-NH2 3.21Å; D505-R738 PolarHBondContact OD1-NH2 3.01Å; D505-R738 IonicContact OD2-NH2 3.26Å; S736-R738 PolarHBondContact O-N 3.17Å; R738-S740 PolarHBondContact O-N 3.1Å
739	R	45.8	Very low	35.3	Very low	47 Å²	47	79.3 Å²	79.3	18%	0.177	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-56.6	132.6	-165.2	-64.7	176.4	178.2	144.7	-0.8	110.5	N710 S746	N710-R739 PolarHBondContact OD1-NH1 3.45Å; R739-S746 PolarHBondContact NH1-OG 2.97Å; R739-S746 PolarHBondContact NH2-OG 3.03Å
740	S	40.4	Very low	35.4	Very low	24 Å²	24	78.6 Å²	78.6	17%	0.168	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-66.7	154.1	162.5	80	0	0	0	0	108.8	R738 V742 D743 S744	R738-S740 PolarHBondContact O-N 3.1Å; S740-V742 PolarHBondContact O-N 2.81Å; S740-V742 VanDerWaalsContact O-N 3.15Å; S740-V742 PolarHBondContact OG-N 2.95Å; S740-D743 WeakPolarHBondContact CB-OD2 3.24Å; S740-D743 PolarHBondContact O-N 2.9Å; S740-D743 PolarHBondContact OG-N 2.89Å; S740-D743 PolarHBondContact OG-OD2 3.08Å; S740-S744 PolarHBondContact O-N 2.85Å; S740-S744 PolarHBondContact O-OG 2.83Å
741	S	40.7	Very low	35.6	Very low	18 Å²	18	79.3 Å²	79.3	13%	0.126	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-28.1	172.6	50.3	0	0	0	0	112.8	S744	S741-S744 WeakPolarHBondContact CA-OG 3.47Å; S741-S744 PolarHBondContact O-OG 3.1Å
742	V	43.7	Very low	35.6	Very low	73 Å²	73	78.3 Å²	78.3	44%	0.442	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-33.1	178	-166.9	0	0	0	0	111.9	S740	S740-V742 PolarHBondContact O-N 2.81Å; S740-V742 VanDerWaalsContact O-N 3.15Å; S740-V742 PolarHBondContact OG-N 2.95Å
743	D	43.5	Very low	35.4	Very low	82 Å²	82	74.9 Å²	74.9	44%	0.439	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-12.4	-178.9	-56.6	-54.4	0	0	0	113.6	S740 M745 P765	S740-D743 WeakPolarHBondContact CB-OD2 3.24Å; S740-D743 PolarHBondContact O-N 2.9Å; S740-D743 PolarHBondContact OG-N 2.89Å; S740-D743 PolarHBondContact OG-OD2 3.08Å; D743-M745 PolarHBondContact O-N 3.37Å; D743-P765 VanDerWaalsContact O-CD 3.3Å; D743-P765 WeakPolarHBondContact O-CD 3.47Å; D743-P765 VanDerWaalsContact O-CG 3.23Å; D743-P765 WeakPolarHBondContact O-CG 3.3Å
744	S	42.8	Very low	35.4	Very low	3 Å²	3	79.9 Å²	79.9	2%	0.021	43%	0.429	C	S	.	.			trans	-98.1	98.6	-173.2	52.3	0	0	0	0	113.1	W706 N710 S740 S741	W706-S744 WeakPolarHBondContact CH2-O 3.01Å; W706-S744 WeakPolarHBondContact CZ3-O 3.45Å; N710-S744 WeakPolarHBondContact ND2-CB 3.23Å; N710-S744 PolarHBondContact ND2-OG 2.94Å; S740-S744 PolarHBondContact O-N 2.85Å; S740-S744 PolarHBondContact O-OG 2.83Å; S741-S744 WeakPolarHBondContact CA-OG 3.47Å; S741-S744 PolarHBondContact O-OG 3.1Å
745	M	42.4	Very low	35.6	Very low	12 Å²	12	81.5 Å²	81.5	6%	0.059	43%	0.428	C	S	.	.			trans	-156.2	38.4	157	-143.1	169.8	-81.3	0	0	109.8	R674 W706 D743 P765 V766 Y767 P857	R674-M745 HydrophobicContact CG-CE 4.25Å; W706-M745 HydrophobicContact CZ3-CG 4.41Å; D743-M745 PolarHBondContact O-N 3.37Å; M745-P765 HydrophobicContact CB-CB 3.96Å; M745-V766 PolarHBondContact O-N 2.7Å; M745-Y767 HydrophobicContact CB-CD2 4.04Å; M745-Y767 HydrophobicContact CG-CD2 3.45Å; M745-Y767 VanDerWaalsContact CG-CD2 3.45Å; M745-Y767 HydrophobicContact CG-CE2 3.81Å; M745-Y767 HydrophobicContact CG-CG 4.19Å; M745-Y767 HydrophobicContact SD-CD1 4.11Å; M745-Y767 HydrophobicContact SD-CD2 3.38Å; M745-Y767 WeakPolarHBondContact SD-CD2 3.36Å; M745-Y767 HydrophobicContact SD-CE1 4.32Å; M745-Y767 HydrophobicContact SD-CE2 3.6Å; M745-Y767 HydrophobicContact SD-CG 3.64Å; M745-P857 HydrophobicContact CG-CG 4.38Å
746	S	37.4	Very low	35.5	Very low	15 Å²	15	80.9 Å²	80.9	11%	0.105	43%	0.434	C	S	.	.			trans	-87.2	110.6	178.1	55.8	0	0	0	0	110.4	R739	R739-S746 PolarHBondContact NH1-OG 2.97Å; R739-S746 PolarHBondContact NH2-OG 3.03Å
747	L	35.3	Very low	35.5	Very low	29 Å²	29	86.6 Å²	86.6	15%	0.152	45%	0.448	C	S	.	.			trans	-81.6	131.2	166.2	-77.1	161.6	0	0	0	109.8	Y749 V766 L855 R856 R858	L747-Y749 PolarHBondContact O-N 3.26Å; L747-V766 HydrophobicContact CB-CB 4.44Å; L747-V766 HydrophobicContact CB-CG2 4.03Å; L747-L855 HydrophobicContact CD1-CD2 4.28Å; L747-R856 VanDerWaalsContact CD1-O 3.3Å; L747-R856 WeakPolarHBondContact CD1-O 3.03Å; L747-R856 WeakPolarHBondContact CD2-O 3.35Å; L747-R858 HydrophobicContact CD2-CB 3.63Å; L747-R858 HydrophobicContact CD2-CG 3.81Å
748	T	33.3	Very low	35.4	Very low	61 Å²	61	80.2 Å²	80.2	37%	0.374	44%	0.44	S	S	.	.			trans	-71.9	106.4	160.2	47.6	0	0	0	0	107.9	P719 S750	P719-T748 WeakPolarHBondContact O-CG2 3.09Å; T748-S750 PolarHBondContact O-N 3.46Å
749	Y	33.2	Very low	34.9	Very low	137 Å²	137	86.8 Å²	86.8	54%	0.537	47%	0.473	S	S	.	.			trans	-73.8	119.9	164.2	-92.2	-95.3	0	0	0	108.3	L747 D751	L747-Y749 PolarHBondContact O-N 3.26Å; Y749-D751 VanDerWaalsContact C-N 3.33Å; Y749-D751 HydrophobicContact CD1-CB 4.48Å
750	S	32.2	Very low	34.3	Very low	64 Å²	64	91.4 Å²	91.4	45%	0.448	50%	0.501	S	S	.	.			trans	-83.4	-9.1	169.4	39.5	0	0	0	0	112.9	T748 S752 Y877	T748-S750 PolarHBondContact O-N 3.46Å; S750-S752 PolarHBondContact O-N 2.72Å; S750-S752 VanDerWaalsContact O-N 3.11Å; S750-Y877 PolarHBondContact OG-OH 3.15Å
751	D	29.6	Very low	33.8	Very low	110 Å²	110	97.6 Å²	97.6	59%	0.588	53%	0.532	S	S	*	.			trans	-71.6	102.6	169.2	-71.2	-41	0	0	0	110.4	Y749 S753	Y749-D751 VanDerWaalsContact C-N 3.33Å; Y749-D751 HydrophobicContact CD1-CB 4.48Å; D751-S753 PolarHBondContact O-N 2.71Å
752	S	30.4	Very low	33.5	Very low	130 Å²	130	105.5 Å²	105.5	91%	0.909	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	31.9	-173.9	66.4	0	0	0	0	114.8	S750	S750-S752 PolarHBondContact O-N 2.72Å; S750-S752 VanDerWaalsContact O-N 3.11Å
753	S	27.5	Very low	33.1	Very low	91 Å²	91	109.1 Å²	109.1	64%	0.636	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	-7.9	-165.7	60	0	0	0	0	116.2	D751	D751-S753 PolarHBondContact O-N 2.71Å
754	F	27.3	Very low	32.9	Very low	191 Å²	191	106.1 Å²	106.1	84%	0.838	56%	0.557	S	S	*	*			trans	-138.1	10.7	-171.7	-107.2	-84.5	0	0	0	118.2	S756	F754-S756 PolarHBondContact O-N 2.86Å
755	I	29.5	Very low	33.3	Very low	136 Å²	136	106.3 Å²	106.3	70%	0.697	56%	0.558	S	S	*	*			trans	-85	98.6	175.7	-56.7	179.7	0	0	0	110.5	K757	I755-K757 PolarHBondContact O-N 3.4Å
756	S	27.1	Very low	33.5	Very low	104 Å²	104	106.6 Å²	106.6	73%	0.727	56%	0.56	S	S	*	*			trans	-69.6	120.2	164	52.4	0	0	0	0	110	F754 S758	F754-S756 PolarHBondContact O-N 2.86Å; S756-S758 PolarHBondContact O-N 2.89Å
757	K	28.6	Very low	34.2	Very low	201 Å²	201	106.4 Å²	106.4	87%	0.874	56%	0.557	S	S	*	*			trans	-70	97	176.3	-68.4	-179.3	176.1	-177.5	0	110.4	I755	I755-K757 PolarHBondContact O-N 3.4Å
758	S	32.2	Very low	35.2	Very low	102 Å²	102	106.1 Å²	106.1	71%	0.713	56%	0.555	S	S	*	*			trans	-85.8	132.6	160.7	52.8	0	0	0	0	109.9	S756 D760	S756-S758 PolarHBondContact O-N 2.89Å; S758-D760 PolarHBondContact O-N 3.35Å
759	Q	31	Very low	36.3	Very low	192 Å²	192	106.1 Å²	106.1	90%	0.897	55%	0.553	S	S	*	*	S	Bend	trans	-79.5	19.8	-162.8	-67.8	175.8	-77.2	0	0	116
760	D	32.5	Very low	37.4	Very low	144 Å²	144	102.5 Å²	102.5	77%	0.77	54%	0.541	S	S	*	.			trans	-112	117.3	-178	-76	-49.8	0	0	0	112.5	S758 K762	S758-D760 PolarHBondContact O-N 3.35Å; D760-K762 PolarHBondContact O-N 3Å
761	N	29.8	Very low	38.6	Very low	155 Å²	155	100.6 Å²	100.6	83%	0.829	52%	0.524	S	S	*	.			trans	-71.1	51.2	-172.1	-78.4	-24.2	0	0	0	115.5
762	K	33.4	Very low	40.1	Very low	183 Å²	183	96 Å²	96	80%	0.796	50%	0.499	S	S	*	.			trans	-133.9	98	170.8	-79.6	-178	178.9	170.7	0	111.7	D760 S764	D760-K762 PolarHBondContact O-N 3Å; K762-S764 PolarHBondContact O-N 2.72Å
763	Y	36.2	Very low	41.5	Very low	149 Å²	149	93.7 Å²	93.7	58%	0.584	48%	0.477	S	S	*	.			trans	-57.1	103.1	169.1	-67.8	-88.4	0	0	0	111.1	G720	G720-Y763 PolarHBondContact O-OH 3.49Å
764	S	39.4	Very low	43	Very low	20 Å²	20	93 Å²	93	14%	0.14	46%	0.463	C	S	.	.			trans	-85.8	142.5	169.3	155.7	0	0	0	0	110	K762 Q768 N769	K762-S764 PolarHBondContact O-N 2.72Å; S764-Q768 PolarHBondContact OG-OE1 3.49Å; S764-N769 WeakPolarHBondContact CB-OD1 3.45Å; S764-N769 PolarHBondContact O-ND2 3.21Å; S764-N769 PolarHBondContact OG-OD1 3.33Å
765	P	51.1	Low	44.5	Very low	6 Å²	6	85.3 Å²	85.3	4%	0.039	43%	0.431	C	S	.	.			trans	-50.5	148.7	178.9	-1.6	-10	0	0	0	113.8	D743 M745 Y767 Q768 N769	D743-P765 VanDerWaalsContact O-CD 3.3Å; D743-P765 WeakPolarHBondContact O-CD 3.47Å; D743-P765 VanDerWaalsContact O-CG 3.23Å; D743-P765 WeakPolarHBondContact O-CG 3.3Å; M745-P765 HydrophobicContact CB-CB 3.96Å; P765-Y767 VanDerWaalsContact C-N 3.32Å; P765-Y767 PolarHBondContact O-N 2.88Å; P765-Q768 HydrophobicContact CB-CB 3.98Å; P765-Q768 HydrophobicContact CG-CB 3.62Å; P765-Q768 HydrophobicContact CG-CG 4.43Å; P765-Q768 CarbonylContact O-C 3.35Å; P765-Q768 WeakPolarHBondContact O-CA 3.23Å; P765-Q768 WeakPolarHBondContact O-CB 3.15Å; P765-Q768 PolarHBondContact O-N 3.27Å; P765-N769 PolarHBondContact O-N 2.95Å
766	V	46.4	Very low	46	Very low	18 Å²	18	82.6 Å²	82.6	11%	0.109	41%	0.414	C	S	.	.	H	α-helix	trans	-61.3	-42	179.6	164.4	0	0	0	0	110.9	M745 L747 Q768 N769 E770 L855	M745-V766 PolarHBondContact O-N 2.7Å; L747-V766 HydrophobicContact CB-CB 4.44Å; L747-V766 HydrophobicContact CB-CG2 4.03Å; V766-Q768 PolarHBondContact O-N 3.31Å; V766-N769 PolarHBondContact O-N 3.42Å; V766-E770 HydrophobicContact CG1-CG 4.17Å; V766-E770 VanDerWaalsContact O-CB 3.27Å; V766-E770 WeakPolarHBondContact O-CB 3.33Å; V766-E770 WeakPolarHBondContact O-CG 3.11Å; V766-E770 PolarHBondContact O-N 2.93Å; V766-L855 HydrophobicContact CG1-CD2 4.29Å
767	Y	52.3	Low	47.3	Very low	11 Å²	11	81.4 Å²	81.4	4%	0.043	41%	0.405	C	S	.	.	H	α-helix	trans	-60.7	-30.5	172.6	-80.2	-104.9	0	0	0	113.3	M745 P765 W771 M846 L849 V850 L855	M745-Y767 HydrophobicContact CB-CD2 4.04Å; M745-Y767 HydrophobicContact CG-CD2 3.45Å; M745-Y767 VanDerWaalsContact CG-CD2 3.45Å; M745-Y767 HydrophobicContact CG-CE2 3.81Å; M745-Y767 HydrophobicContact CG-CG 4.19Å; M745-Y767 HydrophobicContact SD-CD1 4.11Å; M745-Y767 HydrophobicContact SD-CD2 3.38Å; M745-Y767 WeakPolarHBondContact SD-CD2 3.36Å; M745-Y767 HydrophobicContact SD-CE1 4.32Å; M745-Y767 HydrophobicContact SD-CE2 3.6Å; M745-Y767 HydrophobicContact SD-CG 3.64Å; P765-Y767 VanDerWaalsContact C-N 3.32Å; P765-Y767 PolarHBondContact O-N 2.88Å; Y767-W771 WeakPolarHBondContact O-CB 3.41Å; Y767-W771 PolarHBondContact O-N 3.37Å; Y767-W771 VanDerWaalsContact O-N 3.1Å; Y767-M846 HydrophobicContact CD1-CE 4.48Å; Y767-M846 HydrophobicContact CD1-SD 4.38Å; Y767-M846 HydrophobicContact CE1-CE 4.05Å; Y767-L849 HydrophobicContact CD1-CB 4.08Å; Y767-L849 HydrophobicContact CD1-CD1 3.55Å; Y767-L849 HydrophobicContact CD1-CG 4.41Å; Y767-L849 HydrophobicContact CE1-CB 3.87Å; Y767-L849 HydrophobicContact CE1-CD1 4.22Å; Y767-L849 HydrophobicContact CG-CD1 4.3Å; Y767-V850 HydrophobicContact CE1-CG2 4.23Å; Y767-L855 HydrophobicContact CE1-CB 4.42Å; Y767-L855 HydrophobicContact CE2-CB 4.08Å; Y767-L855 VanDerWaalsContact OH-C 3.28Å; Y767-L855 WeakPolarHBondContact OH-CB 3.21Å; Y767-L855 PolarHBondContact OH-O 3.13Å
768	Q	56.6	Low	48.4	Very low	23 Å²	23	73.6 Å²	73.6	11%	0.107	38%	0.375	C	S	.	.	H	α-helix	trans	-83.5	-35.7	179.6	-172.7	171.4	78.9	0	0	111.3	S764 P765 V766 W771 I772 K837	S764-Q768 PolarHBondContact OG-OE1 3.49Å; P765-Q768 HydrophobicContact CB-CB 3.98Å; P765-Q768 HydrophobicContact CG-CB 3.62Å; P765-Q768 HydrophobicContact CG-CG 4.43Å; P765-Q768 CarbonylContact O-C 3.35Å; P765-Q768 WeakPolarHBondContact O-CA 3.23Å; P765-Q768 WeakPolarHBondContact O-CB 3.15Å; P765-Q768 PolarHBondContact O-N 3.27Å; V766-Q768 PolarHBondContact O-N 3.31Å; Q768-W771 HydrophobicContact CG-CE3 4.41Å; Q768-W771 PolarHBondContact O-N 3.5Å; Q768-I772 HydrophobicContact CG-CD1 3.99Å; Q768-I772 VanDerWaalsContact O-CB 3.23Å; Q768-I772 WeakPolarHBondContact O-CB 3.46Å; Q768-I772 WeakPolarHBondContact O-CD1 3.38Å; Q768-I772 WeakPolarHBondContact O-CG1 3.45Å; Q768-I772 PolarHBondContact O-N 2.85Å; Q768-K837 HydrophobicContact CG-CG 4.43Å; Q768-K837 PolarHBondContact NE2-O 2.61Å; Q768-K837 VanDerWaalsContact NE2-O 3.1Å
769	N	56.3	Low	49.1	Very low	61 Å²	61	73.9 Å²	73.9	33%	0.326	37%	0.367	S	S	.	.	H	α-helix	trans	-66.5	-49.7	171.6	-64.8	-17.8	0	0	0	111.2	S764 P765 V766 W771 I772 N773	S764-N769 WeakPolarHBondContact CB-OD1 3.45Å; S764-N769 PolarHBondContact O-ND2 3.21Å; S764-N769 PolarHBondContact OG-OD1 3.33Å; P765-N769 PolarHBondContact O-N 2.95Å; V766-N769 PolarHBondContact O-N 3.42Å; N769-W771 VanDerWaalsContact C-N 3.27Å; N769-W771 PolarHBondContact O-N 3.18Å; N769-I772 PolarHBondContact O-N 3.38Å; N769-N773 VanDerWaalsContact O-CB 3.3Å; N769-N773 WeakPolarHBondContact O-CB 3.29Å; N769-N773 PolarHBondContact O-N 3.19Å; N769-N773 PolarHBondContact O-ND2 2.68Å
770	E	55.8	Low	49.8	Very low	62 Å²	62	69.5 Å²	69.5	29%	0.29	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-37.7	175.5	-74.5	-59.6	122.7	0	0	111.8	V766 F774 L849 L855	V766-E770 HydrophobicContact CG1-CG 4.17Å; V766-E770 VanDerWaalsContact O-CB 3.27Å; V766-E770 WeakPolarHBondContact O-CB 3.33Å; V766-E770 WeakPolarHBondContact O-CG 3.11Å; V766-E770 PolarHBondContact O-N 2.93Å; E770-F774 WeakPolarHBondContact O-CB 3.37Å; E770-F774 PolarHBondContact O-N 3.49Å; E770-L849 HydrophobicContact CB-CD2 3.54Å; E770-L849 HydrophobicContact CG-CD2 4.29Å; E770-L855 HydrophobicContact CG-CD1 4.27Å
771	W	58	Low	50.2	Low	23 Å²	23	66.9 Å²	66.9	9%	0.087	34%	0.336	C	S	.	.	H	α-helix	trans	-71.2	-41.5	174.6	173.8	47.9	0	0	0	113.5	Y767 Q768 N769 N773 F774 T775 L836 K839 T845	Y767-W771 WeakPolarHBondContact O-CB 3.41Å; Y767-W771 PolarHBondContact O-N 3.37Å; Y767-W771 VanDerWaalsContact O-N 3.1Å; Q768-W771 HydrophobicContact CG-CE3 4.41Å; Q768-W771 PolarHBondContact O-N 3.5Å; N769-W771 VanDerWaalsContact C-N 3.27Å; N769-W771 PolarHBondContact O-N 3.18Å; W771-N773 VanDerWaalsContact C-N 3.3Å; W771-N773 PolarHBondContact O-N 3.22Å; W771-F774 PolarHBondContact O-N 3.09Å; W771-T775 WeakPolarHBondContact O-CB 3.43Å; W771-T775 WeakPolarHBondContact O-CG2 3.16Å; W771-T775 PolarHBondContact O-N 2.64Å; W771-T775 PolarHBondContact O-OG1 3.29Å; W771-L836 HydrophobicContact CH2-CB 4.09Å; W771-L836 HydrophobicContact CH2-CD2 4.15Å; W771-L836 WeakPolarHBondContact CH2-O 3.15Å; W771-L836 HydrophobicContact CZ2-CB 4.49Å; W771-L836 HydrophobicContact CZ2-CD2 3.74Å; W771-L836 HydrophobicContact CZ3-CB 4.17Å; W771-L836 WeakPolarHBondContact CZ3-O 3.16Å; W771-K839 HydrophobicContact CH2-CB 4.02Å; W771-T845 HydrophobicContact CB-CG2 4.18Å; W771-T845 HydrophobicContact CG-CG2 3.99Å
772	I	61.1	Low	50.5	Low	13 Å²	13	62.8 Å²	62.8	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-41.3	172.8	-75.7	166.9	0	0	0	110	Q768 N769 T775 K776 L836	Q768-I772 HydrophobicContact CG-CD1 3.99Å; Q768-I772 VanDerWaalsContact O-CB 3.23Å; Q768-I772 WeakPolarHBondContact O-CB 3.46Å; Q768-I772 WeakPolarHBondContact O-CD1 3.38Å; Q768-I772 WeakPolarHBondContact O-CG1 3.45Å; Q768-I772 PolarHBondContact O-N 2.85Å; N769-I772 PolarHBondContact O-N 3.38Å; I772-T775 WeakPolarHBondContact CA-OG1 3.27Å; I772-T775 PolarHBondContact O-OG1 3.37Å; I772-T775 VanDerWaalsContact O-OG1 3.1Å; I772-K776 HydrophobicContact CG2-CD 3.74Å; I772-K776 VanDerWaalsContact CG2-CE 3.5Å; I772-K776 VanDerWaalsContact O-CB 3.23Å; I772-K776 WeakPolarHBondContact O-CB 3.36Å; I772-K776 WeakPolarHBondContact O-CD 3.11Å; I772-K776 WeakPolarHBondContact O-CG 3.4Å; I772-K776 PolarHBondContact O-N 3.34Å; I772-L836 HydrophobicContact CG1-CD1 4.45Å
773	N	60.5	Low	50.5	Low	82 Å²	82	57.1 Å²	57.1	44%	0.439	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-48.9	174.6	-70.1	-16.3	0	0	0	111.2	N769 W771 T775 K776 C777	N769-N773 VanDerWaalsContact O-CB 3.3Å; N769-N773 WeakPolarHBondContact O-CB 3.29Å; N769-N773 PolarHBondContact O-N 3.19Å; N769-N773 PolarHBondContact O-ND2 2.68Å; W771-N773 VanDerWaalsContact C-N 3.3Å; W771-N773 PolarHBondContact O-N 3.22Å; N773-T775 PolarHBondContact O-N 3.24Å; N773-K776 PolarHBondContact O-N 3.23Å; N773-C777 WeakPolarHBondContact O-CB 3.35Å; N773-C777 PolarHBondContact O-N 2.71Å; N773-C777 PolarHBondContact O-SG 3.46Å; N773-C777 VanDerWaalsContact O-SG 3.33Å
774	F	58.3	Low	50.4	Low	78 Å²	78	58.6 Å²	58.6	34%	0.342	30%	0.301	S	S	.	.	H	α-helix	trans	-60	-44	178.4	-179.6	-94.8	0	0	0	112.3	E770 W771 C777 S778 Y848	E770-F774 WeakPolarHBondContact O-CB 3.37Å; E770-F774 PolarHBondContact O-N 3.49Å; W771-F774 PolarHBondContact O-N 3.09Å; F774-C777 PolarHBondContact O-N 3Å; F774-S778 VanDerWaalsContact O-CB 3.28Å; F774-S778 WeakPolarHBondContact O-CB 3.47Å; F774-S778 PolarHBondContact O-N 3.17Å; F774-Y848 HydrophobicContact CD2-CD1 4.18Å; F774-Y848 HydrophobicContact CD2-CE1 4.09Å; F774-Y848 HydrophobicContact CE2-CD1 4.49Å; F774-Y848 HydrophobicContact CE2-CD2 4.41Å; F774-Y848 HydrophobicContact CE2-CG 4.38Å
775	T	58.5	Low	50	Low	29 Å²	29	66.1 Å²	66.1	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-68	-42.5	176.4	47.2	0	0	0	0	112.1	W771 I772 N773 C777 S778 M779 L836	W771-T775 WeakPolarHBondContact O-CB 3.43Å; W771-T775 WeakPolarHBondContact O-CG2 3.16Å; W771-T775 PolarHBondContact O-N 2.64Å; W771-T775 PolarHBondContact O-OG1 3.29Å; I772-T775 WeakPolarHBondContact CA-OG1 3.27Å; I772-T775 PolarHBondContact O-OG1 3.37Å; I772-T775 VanDerWaalsContact O-OG1 3.1Å; N773-T775 PolarHBondContact O-N 3.24Å; T775-C777 PolarHBondContact O-N 3Å; T775-S778 PolarHBondContact O-N 2.86Å; T775-M779 WeakPolarHBondContact O-CB 3.04Å; T775-M779 WeakPolarHBondContact O-CG 3.31Å; T775-M779 PolarHBondContact O-N 3.08Å; T775-L836 HydrophobicContact CG2-CD2 4.49Å
776	K	61.3	Low	49.1	Very low	79 Å²	79	71.5 Å²	71.5	34%	0.343	36%	0.356	S	S	.	.	H	α-helix	trans	-60	-43.9	172.6	-75.3	170.3	-178.7	170	0	111.6	I772 N773 N780 D833	I772-K776 HydrophobicContact CG2-CD 3.74Å; I772-K776 VanDerWaalsContact CG2-CE 3.5Å; I772-K776 VanDerWaalsContact O-CB 3.23Å; I772-K776 WeakPolarHBondContact O-CB 3.36Å; I772-K776 WeakPolarHBondContact O-CD 3.11Å; I772-K776 WeakPolarHBondContact O-CG 3.4Å; I772-K776 PolarHBondContact O-N 3.34Å; N773-K776 PolarHBondContact O-N 3.23Å; K776-N780 WeakPolarHBondContact O-CB 3.28Å; K776-N780 VanDerWaalsContact O-CG 3.23Å; K776-N780 PolarHBondContact O-N 3.42Å; K776-N780 PolarHBondContact O-ND2 3.37Å; K776-D833 WeakPolarHBondContact CE-OD1 3.22Å; K776-D833 VanDerWaalsContact NZ-CG 3.29Å; K776-D833 IonicContact NZ-OD1 2.78Å; K776-D833 PolarHBondContact NZ-OD1 3.1Å; K776-D833 IonicContact NZ-OD2 2.75Å; K776-D833 PolarHBondContact NZ-OD2 2.82Å
777	C	54.7	Low	48.3	Very low	78 Å²	78	78.1 Å²	78.1	53%	0.527	39%	0.388	S	S	.	.	H	α-helix	trans	-65.3	-42.2	174.9	-73.2	0	0	0	0	112.9	N773 F774 T775 N780 N781	N773-C777 WeakPolarHBondContact O-CB 3.35Å; N773-C777 PolarHBondContact O-N 2.71Å; N773-C777 PolarHBondContact O-SG 3.46Å; N773-C777 VanDerWaalsContact O-SG 3.33Å; F774-C777 PolarHBondContact O-N 3Å; T775-C777 PolarHBondContact O-N 3Å; C777-N780 PolarHBondContact O-N 2.76Å; C777-N781 PolarHBondContact O-N 3.04Å; C777-N781 VanDerWaalsContact O-N 3.1Å; C777-N781 PolarHBondContact O-ND2 3.03Å
778	S	51.5	Low	47.2	Very low	37 Å²	37	88 Å²	88	26%	0.259	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-44.9	177.7	-170.7	0	0	0	0	111.5	F774 T775 N781 I782	F774-S778 VanDerWaalsContact O-CB 3.28Å; F774-S778 WeakPolarHBondContact O-CB 3.47Å; F774-S778 PolarHBondContact O-N 3.17Å; T775-S778 PolarHBondContact O-N 2.86Å; S778-N781 PolarHBondContact O-N 3.43Å; S778-I782 WeakPolarHBondContact O-CG1 3.31Å; S778-I782 PolarHBondContact O-N 3.04Å
779	M	46.7	Very low	45.9	Very low	109 Å²	109	91.3 Å²	91.3	54%	0.537	45%	0.45	S	S	.	.	H	α-helix	trans	-65.6	-38.8	175.9	-72.5	-172	160.7	0	0	112.9	T775 N781 I782 S783 L832	T775-M779 WeakPolarHBondContact O-CB 3.04Å; T775-M779 WeakPolarHBondContact O-CG 3.31Å; T775-M779 PolarHBondContact O-N 3.08Å; M779-N781 VanDerWaalsContact C-N 3.28Å; M779-N781 PolarHBondContact O-N 3.36Å; M779-I782 PolarHBondContact O-N 2.93Å; M779-I782 VanDerWaalsContact O-N 3.15Å; M779-S783 PolarHBondContact O-N 2.87Å; M779-S783 VanDerWaalsContact O-N 3.17Å; M779-L832 HydrophobicContact SD-CD2 4.23Å
780	N	45.2	Very low	44.6	Very low	100 Å²	100	94.9 Å²	94.9	54%	0.535	47%	0.47	S	S	.	.	H	α-helix	trans	-68.8	-22.7	176.2	-75.8	-21.4	0	0	0	113.8	K776 C777 S783	K776-N780 WeakPolarHBondContact O-CB 3.28Å; K776-N780 VanDerWaalsContact O-CG 3.23Å; K776-N780 PolarHBondContact O-N 3.42Å; K776-N780 PolarHBondContact O-ND2 3.37Å; C777-N780 PolarHBondContact O-N 2.76Å; N780-S783 PolarHBondContact O-OG 3.24Å; N780-S783 VanDerWaalsContact O-OG 3.05Å
781	N	40.6	Very low	43.2	Very low	89 Å²	89	98.3 Å²	98.3	48%	0.476	50%	0.499	S	S	.	.	H	α-helix	trans	-77	-34.6	170.1	-76.7	-28.8	0	0	0	111.8	C777 S778 M779 R784 Y785	C777-N781 PolarHBondContact O-N 3.04Å; C777-N781 VanDerWaalsContact O-N 3.1Å; C777-N781 PolarHBondContact O-ND2 3.03Å; S778-N781 PolarHBondContact O-N 3.43Å; M779-N781 VanDerWaalsContact C-N 3.28Å; M779-N781 PolarHBondContact O-N 3.36Å; N781-R784 PolarHBondContact O-N 2.88Å; N781-Y785 WeakPolarHBondContact O-CD2 3.3Å; N781-Y785 PolarHBondContact O-N 3.06Å; N781-Y785 VanDerWaalsContact O-N 3.15Å
782	I	36.6	Very low	41.7	Very low	69 Å²	69	104.7 Å²	104.7	35%	0.354	54%	0.535	S	S	.	.	H	α-helix	trans	-65.3	-38.8	176.5	-65.8	165.1	0	0	0	111.3	S778 M779 Y785 N786	S778-I782 WeakPolarHBondContact O-CG1 3.31Å; S778-I782 PolarHBondContact O-N 3.04Å; M779-I782 PolarHBondContact O-N 2.93Å; M779-I782 VanDerWaalsContact O-N 3.15Å; I782-Y785 PolarHBondContact O-N 3.14Å; I782-N786 PolarHBondContact O-N 3.48Å
783	S	34.3	Very low	40.2	Very low	63 Å²	63	109.1 Å²	109.1	44%	0.441	57%	0.567	S	S	.	*	H	α-helix	trans	-66.6	-37.2	176	62.2	0	0	0	0	113.1	M779 N780 N786 M787	M779-S783 PolarHBondContact O-N 2.87Å; M779-S783 VanDerWaalsContact O-N 3.17Å; N780-S783 PolarHBondContact O-OG 3.24Å; N780-S783 VanDerWaalsContact O-OG 3.05Å; S783-N786 PolarHBondContact O-N 2.87Å; S783-M787 PolarHBondContact O-N 2.89Å
784	R	32.2	Very low	38.6	Very low	180 Å²	180	112.7 Å²	112.7	68%	0.679	59%	0.586	S	S	*	*	H	α-helix	trans	-68.8	-32.5	175.8	-76.7	-179.1	177.3	166.1	-0.4	114.1	N781	N781-R784 PolarHBondContact O-N 2.88Å
785	Y	32.2	Very low	37.3	Very low	179 Å²	179	115.1 Å²	115.1	70%	0.702	61%	0.613	S	S	*	*	H	α-helix	trans	-74	-36	175.6	-91.7	-88.9	0	0	0	112.3	N781 I782 M787 R788	N781-Y785 WeakPolarHBondContact O-CD2 3.3Å; N781-Y785 PolarHBondContact O-N 3.06Å; N781-Y785 VanDerWaalsContact O-N 3.15Å; I782-Y785 PolarHBondContact O-N 3.14Å; Y785-M787 VanDerWaalsContact C-N 3.35Å; Y785-M787 PolarHBondContact O-N 3.36Å; Y785-R788 PolarHBondContact O-N 2.93Å
786	N	31.9	Very low	35.8	Very low	119 Å²	119	123.3 Å²	123.3	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-76.5	-15	177.5	-75.5	-14.8	0	0	0	114.6	I782 S783	I782-N786 PolarHBondContact O-N 3.48Å; S783-N786 PolarHBondContact O-N 2.87Å
787	M	30.1	Very low	34.1	Very low	157 Å²	157	127.3 Å²	127.3	77%	0.773	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-6.4	172.1	-77.6	-164.8	160.5	0	0	114.6	S783 Y785 S789	S783-M787 PolarHBondContact O-N 2.89Å; Y785-M787 VanDerWaalsContact C-N 3.35Å; Y785-M787 PolarHBondContact O-N 3.36Å; M787-S789 VanDerWaalsContact C-N 3.32Å; M787-S789 PolarHBondContact O-N 3Å
788	R	28.8	Very low	32.9	Very low	217 Å²	217	129.1 Å²	129.1	82%	0.819	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	1.7	178.8	-90	-176.3	170	-176.9	-2.9	115.2	Y785	Y785-R788 PolarHBondContact O-N 2.93Å
789	S	30	Very low	31.7	Very low	93 Å²	93	136 Å²	136	65%	0.65	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-6.6	174.6	55.4	0	0	0	0	114.4	M787	M787-S789 VanDerWaalsContact C-N 3.32Å; M787-S789 PolarHBondContact O-N 3Å
790	N	27.6	Very low	30.8	Very low	137 Å²	137	137.9 Å²	137.9	73%	0.733	72%	0.723	S	S	*	*	S	Bend	trans	-150.3	99.5	178.2	-91	-32.6	0	0	0	110.1
791	C	26.8	Very low	30	Very low	134 Å²	134	140.3 Å²	140.3	91%	0.905	74%	0.741	S	S	*	*			trans	173	107.1	146.5	-100.1	0	0	0	0	110.3
792	N	27	Very low	29.4	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	76%	0.755	S	S	*	*			trans	-75	161.4	163.3	-81.3	-34.1	0	0	0	110.7
793	S	29.1	Very low	28.9	Very low	106 Å²	106	146.7 Å²	146.7	74%	0.741	78%	0.784	S	S	*	*			trans	75.7	113.4	164.9	71.4	0	0	0	0	119.7
794	N	27.4	Very low	28.5	Very low	157 Å²	157	148.8 Å²	148.8	84%	0.84	80%	0.797	S	S	*	*			trans	48.9	103.9	133.4	-57.9	-13.3	0	0	0	120.9
795	S	30.3	Very low	28.1	Very low	129 Å²	129	148.7 Å²	148.7	90%	0.902	81%	0.81	S	S	*	*				-172.1	151.9	115.6	40.1	0	0	0	0	112.2
796	K	28.4	Very low	28	Very low	201 Å²	201	145.3 Å²	145.3	87%	0.874	81%	0.812	S	S	*	*			trans	-93.5	138.1	176.3	-63.4	171.7	175.5	177.3	0	110
797	L	25.5	Very low	27.8	Very low	163 Å²	163	145.1 Å²	145.1	85%	0.853	82%	0.815	S	S	*	*				-168.2	164.9	129.8	-138.7	63.5	0	0	0	113.1
798	C	29.3	Very low	27.7	Very low	117 Å²	117	143.3 Å²	143.3	79%	0.791	82%	0.815	S	S	*	*			trans	72.1	80.5	169.7	-58.6	0	0	0	0	117
799	Q	25.5	Very low	27.7	Very low	182 Å²	182	141.4 Å²	141.4	85%	0.85	82%	0.815	S	S	*	*			trans	-71.3	175.4	142.6	-66.7	171.5	-79.6	0	0	109.9
800	D	27.4	Very low	27.8	Very low	148 Å²	148	141.5 Å²	141.5	79%	0.791	82%	0.816	S	S	*	*			trans	93	83.1	167.8	-53.7	-17.6	0	0	0	118.2
801	T	29.9	Very low	27.9	Very low	150 Å²	150	142.4 Å²	142.4	92%	0.92	82%	0.82	S	S	*	*				-173.1	136.1	105.3	23.1	0	0	0	0	110.5
802	S	26.7	Very low	28.1	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	81%	0.813	S	S	*	*			trans	-108.6	119.5	-165.9	42.9	0	0	0	0	112.8
803	L	26	Very low	28.3	Very low	183 Å²	183	138.5 Å²	138.5	96%	0.958	80%	0.799	S	S	*	*			trans	-174.8	78.2	156.3	-106.6	149.7	0	0	0	111.9
804	C	26.8	Very low	28.5	Very low	107 Å²	107	137.5 Å²	137.5	72%	0.723	79%	0.792	S	S	*	*			trans	-157.7	93.2	162	-164.8	0	0	0	0	111.5	C806	C804-C806 PolarHBondContact O-N 2.92Å; C804-C806 VanDerWaalsContact SG-SG 3.69Å
805	N	24.2	Very low	28.8	Very low	177 Å²	177	138.9 Å²	138.9	95%	0.947	79%	0.791	S	S	*	*			trans	-84.8	90	169	-78.8	-12.5	0	0	0	109.4
806	C	29.5	Very low	29	Very low	109 Å²	109	142.2 Å²	142.2	74%	0.736	78%	0.783	S	S	*	*			trans	-121.9	112.4	170.5	-77.4	0	0	0	0	109.8	C804	C804-C806 PolarHBondContact O-N 2.92Å; C804-C806 VanDerWaalsContact SG-SG 3.69Å
807	T	27.9	Very low	29.2	Very low	114 Å²	114	138 Å²	138	70%	0.699	77%	0.769	S	S	*	*			trans	-72.3	149.2	176.9	42.5	0	0	0	0	111.9	E809	T807-E809 PolarHBondContact O-N 3.29Å
808	P	28.6	Very low	29.4	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	76%	0.761	S	S	*	*	S	Bend	trans	-87	69.5	-170.3	35.8	-37.1	0	0	0	113.3
809	E	28.4	Very low	29.5	Very low	176 Å²	176	135.5 Å²	135.5	82%	0.822	75%	0.753	S	S	*	*			trans	-111.6	-0.9	173	-70.1	-171	143.2	0	0	114.1	T807 L811	T807-E809 PolarHBondContact O-N 3.29Å; E809-L811 PolarHBondContact O-N 3.03Å
810	S	31.8	Very low	29.9	Very low	95 Å²	95	131.5 Å²	131.5	66%	0.664	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-87.6	6.4	-173.2	61.4	0	0	0	0	116.1	A812	S810-A812 VanDerWaalsContact C-N 3.25Å; S810-A812 PolarHBondContact O-N 3.08Å
811	L	30.2	Very low	29.9	Very low	156 Å²	156	133.2 Å²	133.2	82%	0.817	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-72.7	-8.5	-172.5	-113.6	82.3	0	0	0	115.4	E809	E809-L811 PolarHBondContact O-N 3.03Å
812	A	29.7	Very low	29.8	Very low	91 Å²	91	129.7 Å²	129.7	75%	0.752	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-88.5	-13.6	-174.2	0	0	0	0	0	115.4	S810	S810-A812 VanDerWaalsContact C-N 3.25Å; S810-A812 PolarHBondContact O-N 3.08Å
813	E	32.1	Very low	29.8	Very low	118 Å²	118	130 Å²	130	55%	0.551	72%	0.716	S	S	*	*			trans	-93.7	4	-172.9	-70.5	-158.2	103.2	0	0	115.4	K815 R816	E813-K815 PolarHBondContact O-N 3.28Å; E813-R816 PolarHBondContact O-N 2.89Å; E813-R816 VanDerWaalsContact O-N 3.08Å; E813-R816 IonicContact OE1-CZ 3.96Å; E813-R816 IonicContact OE1-NH1 2.71Å; E813-R816 PolarHBondContact OE1-NH1 3.28Å
814	S	32.8	Very low	29.9	Very low	84 Å²	84	130.3 Å²	130.3	59%	0.587	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-59.6	-19.6	-174.6	66.8	0	0	0	0	115.1	R816 I817	S814-R816 PolarHBondContact O-N 3Å; S814-I817 PolarHBondContact O-N 2.76Å
815	K	33.7	Very low	30	Very low	187 Å²	187	130.8 Å²	130.8	81%	0.813	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-67.5	-11.8	175.2	-74.1	-178.4	177.3	176.7	0	114.7	E813	E813-K815 PolarHBondContact O-N 3.28Å
816	R	34.1	Very low	30.1	Very low	199 Å²	199	129.2 Å²	129.2	75%	0.751	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-93.7	-2.7	178.7	-71.9	178.2	174.1	159.4	-5	114.4	E813 S814	E813-R816 PolarHBondContact O-N 2.89Å; E813-R816 VanDerWaalsContact O-N 3.08Å; E813-R816 IonicContact OE1-CZ 3.96Å; E813-R816 IonicContact OE1-NH1 2.71Å; E813-R816 PolarHBondContact OE1-NH1 3.28Å; S814-R816 PolarHBondContact O-N 3Å
817	I	33.5	Very low	30.2	Very low	113 Å²	113	129.6 Å²	129.6	58%	0.579	71%	0.705	S	S	*	*			trans	-107.7	33.4	-172.9	-38.2	-178	0	0	0	111.9	S814 I820	S814-I817 PolarHBondContact O-N 2.76Å; I817-I820 HydrophobicContact CG2-CD1 4.34Å
818	N	28.5	Very low	30.3	Very low	128 Å²	128	130.1 Å²	130.1	68%	0.684	70%	0.703	S	S	*	*			trans	-94.2	8.3	-178.1	-86.3	-7.4	0	0	0	114.8
819	T	33	Very low	30.3	Very low	99 Å²	99	128.6 Å²	128.6	61%	0.607	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	4.2	-178	8.9	0	0	0	0	115.2
820	I	33.3	Very low	30.7	Very low	97 Å²	97	124.7 Å²	124.7	50%	0.497	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.2	-9.2	179.2	-61.6	176.9	0	0	0	111.9	I817	I817-I820 HydrophobicContact CG2-CD1 4.34Å
821	Y	27.3	Very low	31.4	Very low	184 Å²	184	123.3 Å²	123.3	72%	0.722	68%	0.684	S	S	*	*			trans	-103.6	72.7	-174	-81.7	-89.1	0	0	0	114
822	S	27.3	Very low	32.2	Very low	76 Å²	76	119.6 Å²	119.6	53%	0.531	66%	0.664	S	S	.	*	S	Bend	trans	-165	45.9	163.2	67.9	0	0	0	0	115.8
823	S	28	Very low	33	Very low	117 Å²	117	117.5 Å²	117.5	82%	0.818	64%	0.64	S	S	*	*			trans	-172.4	88.2	159.6	57.3	0	0	0	0	112.2
824	Q	27.8	Very low	33.7	Very low	189 Å²	189	117.3 Å²	117.3	88%	0.883	64%	0.639	S	S	*	*			trans	-94.3	152.4	157.5	-82.8	177.1	-48.2	0	0	109.2
825	C	27.5	Very low	34.2	Very low	118 Å²	118	116.2 Å²	116.2	80%	0.797	63%	0.625	S	S	*	*			trans	70.3	89.8	169.7	-54.9	0	0	0	0	117.2
826	I	27.6	Very low	35	Very low	144 Å²	144	108.4 Å²	108.4	74%	0.738	59%	0.592	S	S	*	*				-167.6	107.6	106	-83.6	147.5	0	0	0	105.9
827	V	31.7	Very low	35.8	Very low	116 Å²	116	102.4 Å²	102.4	70%	0.703	57%	0.571	S	S	*	*			trans	-108.2	91.6	179.1	-179.7	0	0	0	0	108.8
828	N	28.8	Very low	36.5	Very low	126 Å²	126	103.8 Å²	103.8	67%	0.674	58%	0.58	S	S	*	*			trans	-86.8	110.1	169.1	-73.3	-11.1	0	0	0	109.5	I830	N828-I830 PolarHBondContact O-N 3.47Å
829	G	30.2	Very low	37.9	Very low	87 Å²	87	104 Å²	104	90%	0.897	58%	0.575	S	S	*	*	S	Bend	trans	58.5	-17	150.7	0	0	0	0	0	121.7
830	I	34.9	Very low	39.3	Very low	94 Å²	94	104.5 Å²	104.5	48%	0.482	57%	0.57	S	S	.	*			trans	-96.6	133	-170.9	-60.7	169.5	0	0	0	109.6	N828 L832 E834 Q835	N828-I830 PolarHBondContact O-N 3.47Å; I830-L832 PolarHBondContact O-N 3.3Å; I830-E834 HydrophobicContact CG2-CB 3.62Å; I830-Q835 HydrophobicContact CB-CG 4.18Å; I830-Q835 HydrophobicContact CG2-CG 3.85Å; I830-Q835 PolarHBondContact O-NE2 3.13Å
831	S	48.1	Very low	41	Very low	67 Å²	67	100.4 Å²	100.4	47%	0.469	55%	0.55	S	S	.	.			trans	-53.1	138.1	176.7	177.2	0	0	0	0	111.4	D833 E834 Q835	S831-D833 PolarHBondContact O-N 3.25Å; S831-D833 VanDerWaalsContact O-N 3.13Å; S831-D833 PolarHBondContact OG-N 3.25Å; S831-E834 PolarHBondContact O-N 3.31Å; S831-Q835 PolarHBondContact O-N 3.38Å; S831-Q835 VanDerWaalsContact O-N 3.1Å
832	L	45.8	Very low	43.3	Very low	78 Å²	78	96 Å²	96	41%	0.408	54%	0.539	S	S	.	.	H	α-helix	trans	-54.7	-34.6	178.1	-172.7	68.5	0	0	0	111.5	M779 I830 E834 Q835 L836	M779-L832 HydrophobicContact SD-CD2 4.23Å; I830-L832 PolarHBondContact O-N 3.3Å; L832-E834 VanDerWaalsContact C-N 3.34Å; L832-E834 PolarHBondContact O-N 2.9Å; L832-Q835 PolarHBondContact O-N 3.11Å; L832-L836 HydrophobicContact CG-CD1 4.12Å; L832-L836 WeakPolarHBondContact O-CB 3.48Å; L832-L836 VanDerWaalsContact O-CG 3.3Å; L832-L836 WeakPolarHBondContact O-CG 3.46Å; L832-L836 PolarHBondContact O-N 2.77Å
833	D	46.7	Very low	45.8	Very low	47 Å²	47	95 Å²	95	25%	0.251	53%	0.527	S	S	.	.	H	α-helix	trans	-67.3	-29.9	177.3	-71.4	-28.4	0	0	0	112.6	K776 S831 K837	K776-D833 WeakPolarHBondContact CE-OD1 3.22Å; K776-D833 VanDerWaalsContact NZ-CG 3.29Å; K776-D833 IonicContact NZ-OD1 2.78Å; K776-D833 PolarHBondContact NZ-OD1 3.1Å; K776-D833 IonicContact NZ-OD2 2.75Å; K776-D833 PolarHBondContact NZ-OD2 2.82Å; S831-D833 PolarHBondContact O-N 3.25Å; S831-D833 VanDerWaalsContact O-N 3.13Å; S831-D833 PolarHBondContact OG-N 3.25Å; D833-K837 WeakPolarHBondContact O-CB 3.36Å; D833-K837 VanDerWaalsContact O-CD 3.28Å; D833-K837 WeakPolarHBondContact O-CD 3.46Å; D833-K837 WeakPolarHBondContact O-CG 3.33Å; D833-K837 PolarHBondContact O-N 3.24Å
834	E	47.5	Very low	48.1	Very low	113 Å²	113	91.7 Å²	91.7	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-77.4	-38.1	172.2	-83	-175.5	140	0	0	112.6	I830 S831 L832 L836 K837	I830-E834 HydrophobicContact CG2-CB 3.62Å; S831-E834 PolarHBondContact O-N 3.31Å; L832-E834 VanDerWaalsContact C-N 3.34Å; L832-E834 PolarHBondContact O-N 2.9Å; E834-L836 VanDerWaalsContact C-N 3.27Å; E834-L836 PolarHBondContact O-N 3.36Å; E834-K837 PolarHBondContact O-N 3.41Å
835	Q	43.5	Very low	50.5	Low	61 Å²	61	82.9 Å²	82.9	29%	0.285	47%	0.47	S	S	.	.	H	α-helix	trans	-65.7	-32	175.4	-62.2	-167.9	18	0	0	112.6	I830 S831 L832	I830-Q835 HydrophobicContact CB-CG 4.18Å; I830-Q835 HydrophobicContact CG2-CG 3.85Å; I830-Q835 PolarHBondContact O-NE2 3.13Å; S831-Q835 PolarHBondContact O-N 3.38Å; S831-Q835 VanDerWaalsContact O-N 3.1Å; L832-Q835 PolarHBondContact O-N 3.11Å
836	L	49.8	Very low	53.2	Low	23 Å²	23	77.3 Å²	77.3	12%	0.12	43%	0.433	C	S	.	.	H	α-helix	trans	-74.2	-50.8	172.5	-70.6	169.2	0	0	0	110.7	W771 I772 T775 L832 E834 N838 K839	W771-L836 HydrophobicContact CH2-CB 4.09Å; W771-L836 HydrophobicContact CH2-CD2 4.15Å; W771-L836 WeakPolarHBondContact CH2-O 3.15Å; W771-L836 HydrophobicContact CZ2-CB 4.49Å; W771-L836 HydrophobicContact CZ2-CD2 3.74Å; W771-L836 HydrophobicContact CZ3-CB 4.17Å; W771-L836 WeakPolarHBondContact CZ3-O 3.16Å; I772-L836 HydrophobicContact CG1-CD1 4.45Å; T775-L836 HydrophobicContact CG2-CD2 4.49Å; L832-L836 HydrophobicContact CG-CD1 4.12Å; L832-L836 WeakPolarHBondContact O-CB 3.48Å; L832-L836 VanDerWaalsContact O-CG 3.3Å; L832-L836 WeakPolarHBondContact O-CG 3.46Å; L832-L836 PolarHBondContact O-N 2.77Å; E834-L836 VanDerWaalsContact C-N 3.27Å; E834-L836 PolarHBondContact O-N 3.36Å; L836-N838 PolarHBondContact O-N 3.04Å; L836-K839 PolarHBondContact O-N 3.15Å
837	K	50.1	Low	55.9	Low	73 Å²	73	74.6 Å²	74.6	32%	0.317	41%	0.414	S	S	.	.	H	α-helix	trans	-43.6	-36	-174.3	-89.1	164	-176	172	0	115.8	Q768 D833 E834	Q768-K837 HydrophobicContact CG-CG 4.43Å; Q768-K837 PolarHBondContact NE2-O 2.61Å; Q768-K837 VanDerWaalsContact NE2-O 3.1Å; D833-K837 WeakPolarHBondContact O-CB 3.36Å; D833-K837 VanDerWaalsContact O-CD 3.28Å; D833-K837 WeakPolarHBondContact O-CD 3.46Å; D833-K837 WeakPolarHBondContact O-CG 3.33Å; D833-K837 PolarHBondContact O-N 3.24Å; E834-K837 PolarHBondContact O-N 3.41Å
838	N	49	Very low	58.3	Low	143 Å²	143	72.7 Å²	72.7	77%	0.765	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-2.2	-174.7	-64.7	-27.1	0	0	0	116.2	L836	L836-N838 PolarHBondContact O-N 3.04Å
839	K	57.2	Low	60.7	Low	132 Å²	132	66.8 Å²	66.8	57%	0.574	36%	0.363	S	S	*	.	S	Bend	trans	-92.8	143.2	178.2	-68.3	176.5	-179.3	177.1	0	111.7	W771 L836	W771-K839 HydrophobicContact CH2-CB 4.02Å; L836-K839 PolarHBondContact O-N 3.15Å
840	E	63.8	Low	63.3	Low	110 Å²	110	62.7 Å²	62.7	51%	0.514	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-65.4	138.5	168.5	-70	-163.5	159.2	0	0	109.9	D842	E840-D842 PolarHBondContact O-N 3.2Å
841	P	67.7	Low	65.7	Low	11 Å²	11	59.9 Å²	59.9	7%	0.071	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-65	137	177.5	28	-35.1	0	0	0	109.8	T845 M846	P841-T845 HydrophobicContact CB-CG2 4.14Å; P841-M846 HydrophobicContact CB-CG 4.03Å; P841-M846 HydrophobicContact CB-SD 3.97Å; P841-M846 HydrophobicContact CG-CG 3.89Å; P841-M846 HydrophobicContact CG-SD 3.55Å; P841-M846 VanDerWaalsContact CG-SD 3.55Å
842	D	75.9	Confident	67.3	Low	90 Å²	90	62.8 Å²	62.8	48%	0.481	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-70.2	170.6	177.3	69.7	31.5	0	0	0	112.3	E840 G844 T845 M846	E840-D842 PolarHBondContact O-N 3.2Å; D842-G844 VanDerWaalsContact C-N 3.3Å; D842-G844 PolarHBondContact O-N 2.97Å; D842-G844 PolarHBondContact OD1-N 3.35Å; D842-G844 VanDerWaalsContact OD1-N 3.08Å; D842-T845 PolarHBondContact O-N 3.4Å; D842-T845 VanDerWaalsContact OD1-CB 3.28Å; D842-T845 WeakPolarHBondContact OD1-CB 3.43Å; D842-T845 PolarHBondContact OD1-N 3.11Å; D842-T845 PolarHBondContact OD1-OG1 2.86Å; D842-M846 WeakPolarHBondContact O-CG 3.44Å; D842-M846 PolarHBondContact O-N 3.36Å
843	L	80	Confident	68.9	Low	57 Å²	57	63.4 Å²	63.4	30%	0.298	31%	0.314	S	S	.	.	H	α-helix	trans	-59.9	-37.8	-179.2	-177.9	75.6	0	0	0	112.9	Q669 M676 L681 Y847	Q669-L843 HydrophobicContact CB-CD1 4.27Å; Q669-L843 HydrophobicContact CB-CD2 4.38Å; Q669-L843 HydrophobicContact CG-CD1 4.15Å; Q669-L843 HydrophobicContact CG-CD2 4.41Å; M676-L843 HydrophobicContact SD-CD1 3.83Å; L681-L843 HydrophobicContact CD2-CD1 3.71Å; L843-Y847 WeakPolarHBondContact O-CB 3.45Å; L843-Y847 PolarHBondContact O-N 3.48Å
844	G	76.8	Confident	70.5	Confident	46 Å²	46	67.3 Å²	67.3	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-71.3	-41.4	-178	0	0	0	0	0	112	D842 Y847 Y848	D842-G844 VanDerWaalsContact C-N 3.3Å; D842-G844 PolarHBondContact O-N 2.97Å; D842-G844 PolarHBondContact OD1-N 3.35Å; D842-G844 VanDerWaalsContact OD1-N 3.08Å; G844-Y847 PolarHBondContact O-N 3.49Å; G844-Y848 PolarHBondContact O-N 3.16Å
845	T	78.1	Confident	71.8	Confident	4 Å²	4	62.4 Å²	62.4	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-60	-50.6	172.7	-55.6	0	0	0	0	110	W771 P841 D842 Y847 Y848 L849	W771-T845 HydrophobicContact CB-CG2 4.18Å; W771-T845 HydrophobicContact CG-CG2 3.99Å; P841-T845 HydrophobicContact CB-CG2 4.14Å; D842-T845 PolarHBondContact O-N 3.4Å; D842-T845 VanDerWaalsContact OD1-CB 3.28Å; D842-T845 WeakPolarHBondContact OD1-CB 3.43Å; D842-T845 PolarHBondContact OD1-N 3.11Å; D842-T845 PolarHBondContact OD1-OG1 2.86Å; T845-Y847 PolarHBondContact O-N 2.82Å; T845-Y848 PolarHBondContact O-N 3.44Å; T845-L849 HydrophobicContact CG2-CD1 3.85Å; T845-L849 HydrophobicContact CG2-CG 4.44Å; T845-L849 VanDerWaalsContact O-CG 3.3Å; T845-L849 WeakPolarHBondContact O-CG 3.3Å; T845-L849 PolarHBondContact O-N 3.47Å
846	M	83.2	Confident	73.3	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-40.6	177.9	-72.5	-57	-50.8	0	0	112.4	P673 L681 Y767 P841 D842 L849 V850	P673-M846 HydrophobicContact CB-CB 4.3Å; P673-M846 HydrophobicContact CB-CG 3.9Å; L681-M846 HydrophobicContact CD1-CB 4.28Å; L681-M846 HydrophobicContact CD2-CB 3.89Å; Y767-M846 HydrophobicContact CD1-CE 4.48Å; Y767-M846 HydrophobicContact CD1-SD 4.38Å; Y767-M846 HydrophobicContact CE1-CE 4.05Å; P841-M846 HydrophobicContact CB-CG 4.03Å; P841-M846 HydrophobicContact CB-SD 3.97Å; P841-M846 HydrophobicContact CG-CG 3.89Å; P841-M846 HydrophobicContact CG-SD 3.55Å; P841-M846 VanDerWaalsContact CG-SD 3.55Å; D842-M846 WeakPolarHBondContact O-CG 3.44Å; D842-M846 PolarHBondContact O-N 3.36Å; M846-L849 PolarHBondContact O-N 2.81Å; M846-V850 HydrophobicContact CE-CG2 3.56Å; M846-V850 VanDerWaalsContact O-CB 3.25Å; M846-V850 WeakPolarHBondContact O-CB 3.09Å; M846-V850 WeakPolarHBondContact O-CG2 3.48Å; M846-V850 PolarHBondContact O-N 3.04Å
847	Y	85.6	Confident	74.4	Confident	86 Å²	86	59.7 Å²	59.7	34%	0.337	29%	0.293	S	S	.	.	H	α-helix	trans	-59.6	-45	173.3	171.5	-102.3	0	0	0	112.2	L681 L843 G844 T845 C851 K852	L681-Y847 HydrophobicContact CB-CD2 4.23Å; L843-Y847 WeakPolarHBondContact O-CB 3.45Å; L843-Y847 PolarHBondContact O-N 3.48Å; G844-Y847 PolarHBondContact O-N 3.49Å; T845-Y847 PolarHBondContact O-N 2.82Å; Y847-C851 HydrophobicContact CD2-CB 3.81Å; Y847-C851 HydrophobicContact CE2-CB 3.84Å; Y847-C851 WeakPolarHBondContact O-CA 3.44Å; Y847-C851 WeakPolarHBondContact O-CB 3.2Å; Y847-C851 PolarHBondContact O-N 3.41Å; Y847-K852 HydrophobicContact CE1-CG 4.43Å; Y847-K852 PolarHBondContact O-N 2.96Å
848	Y	81.3	Confident	75.2	Confident	76 Å²	76	64 Å²	64	30%	0.298	31%	0.308	S	S	.	.	I	π-helix	trans	-60.3	-52.3	175.7	179.9	-99.7	0	0	0	111.5	F774 G844 T845 K852 Q853	F774-Y848 HydrophobicContact CD2-CD1 4.18Å; F774-Y848 HydrophobicContact CD2-CE1 4.09Å; F774-Y848 HydrophobicContact CE2-CD1 4.49Å; F774-Y848 HydrophobicContact CE2-CD2 4.41Å; F774-Y848 HydrophobicContact CE2-CG 4.38Å; G844-Y848 PolarHBondContact O-N 3.16Å; T845-Y848 PolarHBondContact O-N 3.44Å; Y848-K852 HydrophobicContact CD2-CB 4.08Å; Y848-K852 HydrophobicContact CD2-CG 4.33Å; Y848-K852 HydrophobicContact CE2-CB 4.47Å; Y848-K852 CarbonylContact O-C 3.58Å; Y848-K852 WeakPolarHBondContact O-CA 3.49Å; Y848-K852 VanDerWaalsContact O-CB 3.28Å; Y848-K852 WeakPolarHBondContact O-CB 3.41Å; Y848-K852 PolarHBondContact O-N 3.42Å; Y848-Q853 HydrophobicContact CD1-CG 4.09Å; Y848-Q853 HydrophobicContact CE1-CG 3.64Å; Y848-Q853 VanDerWaalsContact CZ-NE2 3.31Å; Y848-Q853 PolarHBondContact O-N 2.98Å; Y848-Q853 PolarHBondContact OH-NE2 2.77Å
849	L	79.6	Confident	76.2	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	27%	0.274	C	S	.	.	I	π-helix	trans	-66	-44.5	-176	-62.8	175.6	0	0	0	112.6	Y767 E770 T845 M846 Q853 Q854 L855	Y767-L849 HydrophobicContact CD1-CB 4.08Å; Y767-L849 HydrophobicContact CD1-CD1 3.55Å; Y767-L849 HydrophobicContact CD1-CG 4.41Å; Y767-L849 HydrophobicContact CE1-CB 3.87Å; Y767-L849 HydrophobicContact CE1-CD1 4.22Å; Y767-L849 HydrophobicContact CG-CD1 4.3Å; E770-L849 HydrophobicContact CB-CD2 3.54Å; E770-L849 HydrophobicContact CG-CD2 4.29Å; T845-L849 HydrophobicContact CG2-CD1 3.85Å; T845-L849 HydrophobicContact CG2-CG 4.44Å; T845-L849 VanDerWaalsContact O-CG 3.3Å; T845-L849 WeakPolarHBondContact O-CG 3.3Å; T845-L849 PolarHBondContact O-N 3.47Å; M846-L849 PolarHBondContact O-N 2.81Å; L849-Q853 CarbonylContact O-C 3.56Å; L849-Q854 PolarHBondContact O-N 2.97Å; L849-L855 HydrophobicContact CB-CD1 3.95Å; L849-L855 HydrophobicContact CD2-CD1 3.65Å; L849-L855 HydrophobicContact CG-CD1 4.34Å; L849-L855 WeakPolarHBondContact O-CB 3.31Å; L849-L855 PolarHBondContact O-N 3.1Å
850	V	84.1	Confident	76.4	Confident	1 Å²	1	52 Å²	52	1%	0.006	25%	0.25	C	C	.	.	I	π-helix	trans	-85.8	-34.6	-173.9	171.1	0	0	0	0	113.1	P678 L681 Y699 Y767 M846 Q854 R856	P678-V850 HydrophobicContact CB-CG1 4.41Å; P678-V850 HydrophobicContact CG-CG1 3.82Å; L681-V850 HydrophobicContact CD1-CB 3.67Å; L681-V850 HydrophobicContact CD1-CG1 3.73Å; L681-V850 HydrophobicContact CD1-CG2 4.13Å; Y699-V850 WeakPolarHBondContact OH-CG1 3.36Å; Y767-V850 HydrophobicContact CE1-CG2 4.23Å; M846-V850 HydrophobicContact CE-CG2 3.56Å; M846-V850 VanDerWaalsContact O-CB 3.25Å; M846-V850 WeakPolarHBondContact O-CB 3.09Å; M846-V850 WeakPolarHBondContact O-CG2 3.48Å; M846-V850 PolarHBondContact O-N 3.04Å; V850-Q854 WeakPolarHBondContact O-CA 3.28Å; V850-R856 PolarHBondContact O-NH1 2.84Å
851	C	85.6	Confident	76.2	Confident	35 Å²	35	48.1 Å²	48.1	24%	0.236	23%	0.234	C	C	.	.	I	π-helix	trans	-105	-33	-173.6	-52.2	0	0	0	0	113.8	Y847	Y847-C851 HydrophobicContact CD2-CB 3.81Å; Y847-C851 HydrophobicContact CE2-CB 3.84Å; Y847-C851 WeakPolarHBondContact O-CA 3.44Å; Y847-C851 WeakPolarHBondContact O-CB 3.2Å; Y847-C851 PolarHBondContact O-N 3.41Å
852	K	82	Confident	75.5	Confident	128 Å²	128	51.1 Å²	51.1	56%	0.557	26%	0.255	S	S	*	.	I	π-helix	trans	-92.2	-49.9	176.9	-61.7	-66.1	-172.6	174.5	0	112	Y847 Y848 Q854	Y847-K852 HydrophobicContact CE1-CG 4.43Å; Y847-K852 PolarHBondContact O-N 2.96Å; Y848-K852 HydrophobicContact CD2-CB 4.08Å; Y848-K852 HydrophobicContact CD2-CG 4.33Å; Y848-K852 HydrophobicContact CE2-CB 4.47Å; Y848-K852 CarbonylContact O-C 3.58Å; Y848-K852 WeakPolarHBondContact O-CA 3.49Å; Y848-K852 VanDerWaalsContact O-CB 3.28Å; Y848-K852 WeakPolarHBondContact O-CB 3.41Å; Y848-K852 PolarHBondContact O-N 3.42Å; K852-Q854 VanDerWaalsContact C-N 3.32Å
853	Q	79.7	Confident	74.5	Confident	91 Å²	91	47.8 Å²	47.8	43%	0.425	24%	0.236	S	C	.	.	S	Bend	trans	-84.1	-5.1	177.8	-61	-60.6	-13.3	0	0	113.8	Y848 L849 L855	Y848-Q853 HydrophobicContact CD1-CG 4.09Å; Y848-Q853 HydrophobicContact CE1-CG 3.64Å; Y848-Q853 VanDerWaalsContact CZ-NE2 3.31Å; Y848-Q853 PolarHBondContact O-N 2.98Å; Y848-Q853 PolarHBondContact OH-NE2 2.77Å; L849-Q853 CarbonylContact O-C 3.56Å; Q853-L855 HydrophobicContact CB-CD1 4Å; Q853-L855 HydrophobicContact CB-CG 3.91Å; Q853-L855 PolarHBondContact O-N 2.9Å
854	Q	79.6	Confident	72.9	Confident	130 Å²	130	46.4 Å²	46.4	61%	0.607	23%	0.231	S	C	*	.			trans	51.7	24.6	-179.3	-55	-167.2	15.3	0	0	114.8	L849 V850 K852 R856	L849-Q854 PolarHBondContact O-N 2.97Å; V850-Q854 WeakPolarHBondContact O-CA 3.28Å; K852-Q854 VanDerWaalsContact C-N 3.32Å; Q854-R856 PolarHBondContact O-N 3.46Å
855	L	74.6	Confident	71.3	Confident	9 Å²	9	46.4 Å²	46.4	5%	0.047	22%	0.219	C	C	.	.			trans	-61.2	132.6	-177	-69.1	165.1	0	0	0	110.3	L747 V766 Y767 E770 L849 Q853	L747-L855 HydrophobicContact CD1-CD2 4.28Å; V766-L855 HydrophobicContact CG1-CD2 4.29Å; Y767-L855 HydrophobicContact CE1-CB 4.42Å; Y767-L855 HydrophobicContact CE2-CB 4.08Å; Y767-L855 VanDerWaalsContact OH-C 3.28Å; Y767-L855 WeakPolarHBondContact OH-CB 3.21Å; Y767-L855 PolarHBondContact OH-O 3.13Å; E770-L855 HydrophobicContact CG-CD1 4.27Å; L849-L855 HydrophobicContact CB-CD1 3.95Å; L849-L855 HydrophobicContact CD2-CD1 3.65Å; L849-L855 HydrophobicContact CG-CD1 4.34Å; L849-L855 WeakPolarHBondContact O-CB 3.31Å; L849-L855 PolarHBondContact O-N 3.1Å; Q853-L855 HydrophobicContact CB-CD1 4Å; Q853-L855 HydrophobicContact CB-CG 3.91Å; Q853-L855 PolarHBondContact O-N 2.9Å
856	R	74.6	Confident	69.3	Low	27 Å²	27	52.1 Å²	52.1	10%	0.102	25%	0.25	C	S	.	.			trans	-141.2	135.8	174	-63.4	-63.5	-178.8	-79.6	-3.2	107.8	P678 L747 V850 Q854 W973	P678-R856 VanDerWaalsContact CG-NH2 3.31Å; L747-R856 VanDerWaalsContact CD1-O 3.3Å; L747-R856 WeakPolarHBondContact CD1-O 3.03Å; L747-R856 WeakPolarHBondContact CD2-O 3.35Å; V850-R856 PolarHBondContact O-NH1 2.84Å; Q854-R856 PolarHBondContact O-N 3.46Å; R856-W973 HydrophobicContact CG-CG 4.43Å; R856-W973 PolarHBondContact NE-O 3.37Å; R856-W973 VanDerWaalsContact NE-O 3.09Å
857	P	73.5	Confident	67.1	Low	1 Å²	1	56.8 Å²	56.8	1%	0.006	27%	0.274	C	S	.	.			trans	-54.4	156.3	169.8	-21.7	33.1	0	0	0	111.4	L703 W706 M745 W973	L703-P857 HydrophobicContact CD2-CG 3.76Å; W706-P857 HydrophobicContact CD2-CB 3.49Å; W706-P857 VanDerWaalsContact CD2-CB 3.49Å; W706-P857 HydrophobicContact CD2-CG 4.19Å; W706-P857 HydrophobicContact CE3-CB 4.1Å; W706-P857 HydrophobicContact CE3-CG 4.35Å; W706-P857 HydrophobicContact CG-CB 3.66Å; W706-P857 HydrophobicContact CG-CG 4.49Å; W706-P857 HydrophobicContact CZ2-CB 4.15Å; M745-P857 HydrophobicContact CG-CG 4.38Å; P857-W973 HydrophobicContact CB-CH2 3.97Å; P857-W973 HydrophobicContact CB-CZ3 4.27Å; P857-W973 HydrophobicContact CG-CZ3 4.37Å; P857-W973 VanDerWaalsContact O-CH2 3.31Å; P857-W973 WeakPolarHBondContact O-CH2 3.24Å; P857-W973 WeakPolarHBondContact O-CZ2 3.35Å
858	R	67.1	Low	64.5	Low	164 Å²	164	56.1 Å²	56.1	62%	0.619	28%	0.279	S	S	*	.			trans	-138.1	156.4	176.2	-67.9	-173.6	179.8	-174.5	0.9	108.2	W706 L747	W706-R858 PolarHBondContact NE1-O 3.3Å; L747-R858 HydrophobicContact CD2-CB 3.63Å; L747-R858 HydrophobicContact CD2-CG 3.81Å
859	I	69.8	Low	62.2	Low	10 Å²	10	58.8 Å²	58.8	5%	0.051	30%	0.298	C	S	.	.			trans	-102.8	129.9	164.9	-65.7	168.5	0	0	0	105.8	V709 W718 A962 F965 A966 L969	V709-I859 HydrophobicContact CB-CD1 4.48Å; V709-I859 HydrophobicContact CG1-CD1 3.77Å; V709-I859 HydrophobicContact CG1-CG1 4.39Å; W718-I859 HydrophobicContact CH2-CG1 4.46Å; I859-A962 HydrophobicContact CG2-CB 4.21Å; I859-F965 HydrophobicContact CD1-CB 3.39Å; I859-A966 HydrophobicContact CB-CB 4.03Å; I859-A966 HydrophobicContact CG2-CB 4.25Å; I859-L969 HydrophobicContact CD1-CD1 3.6Å; I859-L969 HydrophobicContact CG1-CD1 4.28Å
860	P	62.7	Low	59.9	Low	11 Å²	11	67.9 Å²	67.9	7%	0.071	34%	0.341	C	S	.	.			trans	-58	138.5	176	-28.7	37.9	0	0	0	111.9	W718 P719	W718-P860 HydrophobicContact CB-CG 4.35Å; W718-P860 HydrophobicContact CD2-CG 3.89Å; W718-P860 HydrophobicContact CE3-CG 3.43Å; W718-P860 VanDerWaalsContact CE3-CG 3.43Å; W718-P860 HydrophobicContact CG-CG 4.31Å; W718-P860 HydrophobicContact CZ3-CG 3.99Å; P719-P860 HydrophobicContact CG-CB 4.08Å
861	T	58.9	Low	57.2	Low	30 Å²	30	72 Å²	72	18%	0.184	37%	0.366	C	S	.	.			trans	-129.1	5.1	-173.6	39	0	0	0	0	112.9	F863 Y877 I882 A966	T861-F863 HydrophobicContact CG2-CE2 3.88Å; T861-F863 HydrophobicContact CG2-CZ 4.13Å; T861-F863 VanDerWaalsContact O-CD2 3.23Å; T861-F863 WeakPolarHBondContact O-CD2 3.41Å; T861-F863 PolarHBondContact O-N 2.71Å; T861-Y877 WeakPolarHBondContact OG1-CD1 3.49Å; T861-I882 HydrophobicContact CG2-CD1 3.74Å; T861-I882 HydrophobicContact CG2-CG1 4.23Å; T861-A966 HydrophobicContact CG2-CB 3.36Å
862	S	53.1	Low	54.6	Low	73 Å²	73	80.1 Å²	80.1	51%	0.51	40%	0.397	S	S	.	.			trans	-72.9	69.1	164.4	61.1	0	0	0	0	109.2	P719	P719-S862 WeakPolarHBondContact CG-OG 3.38Å
863	F	53.7	Low	52.1	Low	20 Å²	20	78.7 Å²	78.7	9%	0.088	40%	0.395	C	S	.	.			trans	-73.2	146.8	171.6	-56.9	-57.1	0	0	0	108.8	T861 I865 I882 F885 Y959 A962	T861-F863 HydrophobicContact CG2-CE2 3.88Å; T861-F863 HydrophobicContact CG2-CZ 4.13Å; T861-F863 VanDerWaalsContact O-CD2 3.23Å; T861-F863 WeakPolarHBondContact O-CD2 3.41Å; T861-F863 PolarHBondContact O-N 2.71Å; F863-I865 VanDerWaalsContact C-N 3.3Å; F863-I865 HydrophobicContact CB-CD1 3.66Å; F863-I865 HydrophobicContact CB-CG1 3.83Å; F863-I865 PolarHBondContact O-N 3.23Å; F863-I882 HydrophobicContact CE2-CG2 4.43Å; F863-F885 HydrophobicContact CB-CD1 4.47Å; F863-F885 HydrophobicContact CB-CE1 3.86Å; F863-F885 HydrophobicContact CB-CE2 4.17Å; F863-F885 HydrophobicContact CB-CZ 3.64Å; F863-F885 AromaticContact CD1-CE1 3.82Å; F863-F885 HydrophobicContact CD1-CE1 3.82Å; F863-F885 HydrophobicContact CD1-CZ 4.06Å; F863-F885 AromaticContact CD2-CD1 3.4Å; F863-F885 HydrophobicContact CD2-CD1 3.4Å; F863-F885 VanDerWaalsContact CD2-CD1 3.4Å; F863-F885 AromaticContact CD2-CE1 3.19Å; F863-F885 HydrophobicContact CD2-CE1 3.19Å; F863-F885 HydrophobicContact CD2-CG 4.29Å; F863-F885 AromaticContact CD2-CZ 3.92Å; F863-F885 HydrophobicContact CD2-CZ 3.92Å; F863-F885 HydrophobicContact CE1-CE1 4.13Å; F863-F885 AromaticContact CE2-CD1 3.73Å; F863-F885 HydrophobicContact CE2-CD1 3.73Å; F863-F885 AromaticContact CE2-CE1 3.55Å; F863-F885 HydrophobicContact CE2-CE1 3.55Å; F863-F885 AromaticContact CG-CD1 3.99Å; F863-F885 HydrophobicContact CG-CD1 3.99Å; F863-F885 AromaticContact CG-CE1 3.32Å; F863-F885 HydrophobicContact CG-CE1 3.32Å; F863-F885 AromaticContact CG-CZ 3.6Å; F863-F885 HydrophobicContact CG-CZ 3.6Å; F863-F885 HydrophobicContact CZ-CE1 4.01Å; F863-Y959 AromaticContact CD1-CD1 3.56Å; F863-Y959 HydrophobicContact CD1-CD1 3.56Å; F863-Y959 HydrophobicContact CD1-CE1 4.05Å; F863-Y959 AromaticContact CE1-CD1 3.93Å; F863-Y959 HydrophobicContact CE1-CD1 3.93Å; F863-A962 HydrophobicContact CE1-CB 4.2Å; F863-A962 HydrophobicContact CZ-CB 4.29Å
864	P	46.9	Very low	50	Low	28 Å²	28	81 Å²	81	18%	0.182	41%	0.408	C	S	.	.	S	Bend	trans	-72.2	82.5	-177	28.9	-35.6	0	0	0	111.4	A918 I919	P864-A918 HydrophobicContact CB-CB 4.08Å; P864-I919 HydrophobicContact CG-CG1 4.31Å
865	I	43.2	Very low	48.1	Very low	46 Å²	46	79.4 Å²	79.4	24%	0.236	40%	0.404	C	S	.	.			trans	-130.2	77.7	-171.6	-50.1	171	0	0	0	110.7	F863 I867 F885	F863-I865 VanDerWaalsContact C-N 3.3Å; F863-I865 HydrophobicContact CB-CD1 3.66Å; F863-I865 HydrophobicContact CB-CG1 3.83Å; F863-I865 PolarHBondContact O-N 3.23Å; I865-I867 VanDerWaalsContact C-N 3.26Å; I865-I867 HydrophobicContact CG2-CB 3.89Å; I865-I867 HydrophobicContact CG2-CD1 3.31Å; I865-I867 HydrophobicContact CG2-CG1 3.39Å; I865-I867 PolarHBondContact O-N 2.87Å; I865-I867 VanDerWaalsContact O-N 3.17Å; I865-F885 HydrophobicContact CD1-CB 3.78Å; I865-F885 HydrophobicContact CD1-CD1 4.21Å; I865-F885 HydrophobicContact CD1-CD2 3.14Å; I865-F885 HydrophobicContact CD1-CE2 3.57Å; I865-F885 HydrophobicContact CD1-CG 3.46Å; I865-F885 VanDerWaalsContact CD1-CG 3.46Å; I865-F885 HydrophobicContact CD1-CZ 4.24Å; I865-F885 HydrophobicContact CG1-CD2 3.88Å; I865-F885 HydrophobicContact CG1-CE2 3.91Å
866	N	36.1	Very low	46.6	Very low	125 Å²	125	84.4 Å²	84.4	67%	0.668	43%	0.431	S	S	*	.			trans	-82	75.8	157.4	-97.2	-18.9	0	0	0	108.7	T868	N866-T868 VanDerWaalsContact C-N 3.32Å
867	I	38.2	Very low	45.5	Very low	100 Å²	100	87.9 Å²	87.9	51%	0.513	45%	0.445	S	S	.	.			trans	-70.9	-28.5	178.3	-94.6	170	0	0	0	112	I865 I888	I865-I867 VanDerWaalsContact C-N 3.26Å; I865-I867 HydrophobicContact CG2-CB 3.89Å; I865-I867 HydrophobicContact CG2-CD1 3.31Å; I865-I867 HydrophobicContact CG2-CG1 3.39Å; I865-I867 PolarHBondContact O-N 2.87Å; I865-I867 VanDerWaalsContact O-N 3.17Å; I867-I888 HydrophobicContact CD1-CD1 3.52Å
868	T	31	Very low	44.9	Very low	72 Å²	72	89.7 Å²	89.7	44%	0.442	46%	0.457	S	S	.	.			trans	-133.4	124.3	175.2	41	0	0	0	0	111.1	N866	N866-T868 VanDerWaalsContact C-N 3.32Å
869	N	31.8	Very low	44.8	Very low	131 Å²	131	85.7 Å²	85.7	70%	0.701	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	144.2	149.1	-70.2	-1.3	0	0	0	106.3
870	E	30.9	Very low	44.7	Very low	194 Å²	194	92.1 Å²	92.1	91%	0.907	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	32.2	-175	-49.8	-179	-177.5	0	0	117.7
871	T	28.9	Very low	44.9	Very low	87 Å²	87	95.3 Å²	95.3	53%	0.534	49%	0.492	S	S	.	.			trans	-145	136.2	141.5	41	0	0	0	0	111	I873	T871-I873 PolarHBondContact O-N 3.41Å; T871-I873 VanDerWaalsContact O-N 3.11Å
872	K	29.6	Very low	45.3	Very low	205 Å²	205	94.8 Å²	94.8	89%	0.891	49%	0.488	S	S	*	.			trans	-69.3	100.5	154.6	-83.9	-177.1	174.6	-179.9	0	106.2	I874	K872-I874 VanDerWaalsContact C-N 3.27Å; K872-I874 PolarHBondContact O-N 2.97Å
873	I	31	Very low	46.3	Very low	99 Å²	99	94.1 Å²	94.1	51%	0.508	48%	0.477	S	S	.	.			trans	-71	93.2	169.2	-57.5	178	0	0	0	106.9	T871 D875	T871-I873 PolarHBondContact O-N 3.41Å; T871-I873 VanDerWaalsContact O-N 3.11Å; I873-D875 PolarHBondContact O-N 3.11Å
874	I	33.8	Very low	47.2	Very low	138 Å²	138	95.6 Å²	95.6	71%	0.708	49%	0.49	S	S	*	.			trans	-67.2	105.3	162.4	-61.1	168.2	0	0	0	105.5	K872 D876	K872-I874 VanDerWaalsContact C-N 3.27Å; K872-I874 PolarHBondContact O-N 2.97Å; I874-D876 WeakPolarHBondContact O-CA 3.25Å; I874-D876 WeakPolarHBondContact O-CB 3.37Å; I874-D876 PolarHBondContact O-N 3.49Å
875	D	41.6	Very low	48.4	Very low	98 Å²	98	94.7 Å²	94.7	52%	0.524	48%	0.483	S	S	.	.			trans	32.5	39	153.5	-80	-71.5	0	0	0	118.2	I873 Y877	I873-D875 PolarHBondContact O-N 3.11Å; D875-Y877 HydrophobicContact CB-CD2 4.45Å; D875-Y877 HydrophobicContact CB-CE2 3.76Å; D875-Y877 WeakPolarHBondContact O-CD2 3.48Å; D875-Y877 VanDerWaalsContact O-CE2 3.26Å; D875-Y877 WeakPolarHBondContact O-CE2 3.37Å; D875-Y877 PolarHBondContact O-N 2.91Å; D875-Y877 PolarHBondContact OD1-OH 3.12Å
876	D	42.1	Very low	50	Low	114 Å²	114	92.7 Å²	92.7	61%	0.61	47%	0.473	S	S	*	.			trans	-90.4	79.4	-167.1	-134.5	-11.5	0	0	0	110.2	I874 S878 N881	I874-D876 WeakPolarHBondContact O-CA 3.25Å; I874-D876 WeakPolarHBondContact O-CB 3.37Å; I874-D876 PolarHBondContact O-N 3.49Å; D876-S878 PolarHBondContact O-N 2.95Å; D876-N881 PolarHBondContact O-ND2 3.22Å
877	Y	52.2	Low	52	Low	100 Å²	100	89.6 Å²	89.6	39%	0.392	45%	0.454	S	S	.	.			trans	-64.9	33.3	-178.9	-62.2	-77.7	0	0	0	114.3	S750 T861 D875	S750-Y877 PolarHBondContact OG-OH 3.15Å; T861-Y877 WeakPolarHBondContact OG1-CD1 3.49Å; D875-Y877 HydrophobicContact CB-CD2 4.45Å; D875-Y877 HydrophobicContact CB-CE2 3.76Å; D875-Y877 WeakPolarHBondContact O-CD2 3.48Å; D875-Y877 VanDerWaalsContact O-CE2 3.26Å; D875-Y877 WeakPolarHBondContact O-CE2 3.37Å; D875-Y877 PolarHBondContact O-N 2.91Å; D875-Y877 PolarHBondContact OD1-OH 3.12Å
878	S	60.2	Low	53.8	Low	38 Å²	38	87.2 Å²	87.2	27%	0.266	44%	0.442	S	S	.	.			trans	-68.3	139.8	-179.5	86.6	0	0	0	0	111.5	D876 Q880 N881 I882	D876-S878 PolarHBondContact O-N 2.95Å; S878-Q880 PolarHBondContact O-N 2.91Å; S878-Q880 VanDerWaalsContact O-N 3.15Å; S878-N881 PolarHBondContact O-N 3.39Å; S878-N881 VanDerWaalsContact O-N 3.1Å; S878-N881 WeakPolarHBondContact OG-CB 3.35Å; S878-N881 PolarHBondContact OG-N 3.11Å; S878-N881 VanDerWaalsContact OG-N 3.12Å; S878-N881 PolarHBondContact OG-ND2 3Å; S878-N881 VanDerWaalsContact OG-ND2 3.08Å; S878-N881 PolarHBondContact OG-OD1 3.41Å; S878-I882 PolarHBondContact O-N 3.23Å
879	H	64.3	Low	56	Low	80 Å²	80	83.8 Å²	83.8	37%	0.37	42%	0.421	S	S	.	.	H	α-helix	trans	-56.4	-30.4	174.8	-176.8	-80.4	0	0	0	111.9	Q883 M967 E971	H879-Q883 VanDerWaalsContact O-CB 3.32Å; H879-Q883 WeakPolarHBondContact O-CB 3.45Å; H879-Q883 PolarHBondContact O-N 3.46Å; H879-M967 WeakPolarHBondContact CE1-CE 3.41Å; H879-M967 WeakPolarHBondContact NE2-CE 3.44Å; H879-E971 IonicContact NE2-OE1 3.02Å
880	Q	68	Low	58.1	Low	145 Å²	145	79.1 Å²	79.1	68%	0.678	40%	0.397	S	S	*	.	H	α-helix	trans	-70.2	-36.3	178.3	-172.9	171.5	-4.7	0	0	112.9	S878 S884	S878-Q880 PolarHBondContact O-N 2.91Å; S878-Q880 VanDerWaalsContact O-N 3.15Å; Q880-S884 WeakPolarHBondContact O-CB 3.47Å; Q880-S884 PolarHBondContact O-N 3.06Å; Q880-S884 PolarHBondContact O-OG 3.49Å
881	N	66.4	Low	60.4	Low	78 Å²	78	74.8 Å²	74.8	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-66.7	-45.7	175.9	-69.6	-18.2	0	0	0	110.9	D876 S878 S884 F885	D876-N881 PolarHBondContact O-ND2 3.22Å; S878-N881 PolarHBondContact O-N 3.39Å; S878-N881 VanDerWaalsContact O-N 3.1Å; S878-N881 WeakPolarHBondContact OG-CB 3.35Å; S878-N881 PolarHBondContact OG-N 3.11Å; S878-N881 VanDerWaalsContact OG-N 3.12Å; S878-N881 PolarHBondContact OG-ND2 3Å; S878-N881 VanDerWaalsContact OG-ND2 3.08Å; S878-N881 PolarHBondContact OG-OD1 3.41Å; N881-S884 PolarHBondContact O-N 3.43Å; N881-F885 PolarHBondContact O-N 3.12Å
882	I	67.7	Low	62.5	Low	20 Å²	20	71.1 Å²	71.1	10%	0.103	35%	0.353	C	S	.	.	H	α-helix	trans	-67.5	-38.5	178.4	-52.4	164.9	0	0	0	111	T861 F863 S878 F885 C886 M967	T861-I882 HydrophobicContact CG2-CD1 3.74Å; T861-I882 HydrophobicContact CG2-CG1 4.23Å; F863-I882 HydrophobicContact CE2-CG2 4.43Å; S878-I882 PolarHBondContact O-N 3.23Å; I882-F885 WeakPolarHBondContact O-CB 3.32Å; I882-F885 PolarHBondContact O-N 3.37Å; I882-C886 PolarHBondContact O-N 2.87Å; I882-C886 PolarHBondContact O-SG 3.26Å; I882-M967 HydrophobicContact CB-CG 3.88Å; I882-M967 HydrophobicContact CB-SD 4.18Å; I882-M967 HydrophobicContact CD1-CG 4.49Å; I882-M967 HydrophobicContact CG2-CG 3.56Å; I882-M967 HydrophobicContact CG2-SD 3.8Å
883	Q	74.5	Confident	64.5	Low	59 Å²	59	61.5 Å²	61.5	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-51	173.7	179.9	169.2	-19.7	0	0	111.3	H879 F885 C886 E887 M967	H879-Q883 VanDerWaalsContact O-CB 3.32Å; H879-Q883 WeakPolarHBondContact O-CB 3.45Å; H879-Q883 PolarHBondContact O-N 3.46Å; Q883-F885 VanDerWaalsContact C-N 3.26Å; Q883-F885 PolarHBondContact O-N 3.41Å; Q883-C886 PolarHBondContact O-N 3.03Å; Q883-E887 WeakPolarHBondContact CG-OE1 3.5Å; Q883-E887 PolarHBondContact NE2-OE1 2.92Å; Q883-E887 WeakPolarHBondContact O-CG 3.45Å; Q883-E887 PolarHBondContact O-N 3.11Å; Q883-M967 HydrophobicContact CB-CE 3.64Å; Q883-M967 HydrophobicContact CB-SD 4.39Å; Q883-M967 HydrophobicContact CG-CE 4.26Å
884	S	72.8	Confident	66.6	Low	51 Å²	51	58.5 Å²	58.5	36%	0.357	30%	0.297	S	S	.	.	H	α-helix	trans	-57.6	-40.4	179.2	-56.4	0	0	0	0	111.5	Q880 N881 E887 I888	Q880-S884 WeakPolarHBondContact O-CB 3.47Å; Q880-S884 PolarHBondContact O-N 3.06Å; Q880-S884 PolarHBondContact O-OG 3.49Å; N881-S884 PolarHBondContact O-N 3.43Å; S884-E887 PolarHBondContact O-N 2.94Å; S884-I888 WeakPolarHBondContact O-CD1 3.13Å; S884-I888 VanDerWaalsContact O-CG1 3.25Å; S884-I888 WeakPolarHBondContact O-CG1 3.33Å; S884-I888 PolarHBondContact O-N 3.04Å
885	F	72.4	Confident	68.3	Low	8 Å²	8	55.7 Å²	55.7	4%	0.035	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-46.5	173.1	171.3	-122.2	0	0	0	113.1	F863 I865 N881 I882 Q883 E887 I888 L889	F863-F885 HydrophobicContact CB-CD1 4.47Å; F863-F885 HydrophobicContact CB-CE1 3.86Å; F863-F885 HydrophobicContact CB-CE2 4.17Å; F863-F885 HydrophobicContact CB-CZ 3.64Å; F863-F885 AromaticContact CD1-CE1 3.82Å; F863-F885 HydrophobicContact CD1-CE1 3.82Å; F863-F885 HydrophobicContact CD1-CZ 4.06Å; F863-F885 AromaticContact CD2-CD1 3.4Å; F863-F885 HydrophobicContact CD2-CD1 3.4Å; F863-F885 VanDerWaalsContact CD2-CD1 3.4Å; F863-F885 AromaticContact CD2-CE1 3.19Å; F863-F885 HydrophobicContact CD2-CE1 3.19Å; F863-F885 HydrophobicContact CD2-CG 4.29Å; F863-F885 AromaticContact CD2-CZ 3.92Å; F863-F885 HydrophobicContact CD2-CZ 3.92Å; F863-F885 HydrophobicContact CE1-CE1 4.13Å; F863-F885 AromaticContact CE2-CD1 3.73Å; F863-F885 HydrophobicContact CE2-CD1 3.73Å; F863-F885 AromaticContact CE2-CE1 3.55Å; F863-F885 HydrophobicContact CE2-CE1 3.55Å; F863-F885 AromaticContact CG-CD1 3.99Å; F863-F885 HydrophobicContact CG-CD1 3.99Å; F863-F885 AromaticContact CG-CE1 3.32Å; F863-F885 HydrophobicContact CG-CE1 3.32Å; F863-F885 AromaticContact CG-CZ 3.6Å; F863-F885 HydrophobicContact CG-CZ 3.6Å; F863-F885 HydrophobicContact CZ-CE1 4.01Å; I865-F885 HydrophobicContact CD1-CB 3.78Å; I865-F885 HydrophobicContact CD1-CD1 4.21Å; I865-F885 HydrophobicContact CD1-CD2 3.14Å; I865-F885 HydrophobicContact CD1-CE2 3.57Å; I865-F885 HydrophobicContact CD1-CG 3.46Å; I865-F885 VanDerWaalsContact CD1-CG 3.46Å; I865-F885 HydrophobicContact CD1-CZ 4.24Å; I865-F885 HydrophobicContact CG1-CD2 3.88Å; I865-F885 HydrophobicContact CG1-CE2 3.91Å; N881-F885 PolarHBondContact O-N 3.12Å; I882-F885 WeakPolarHBondContact O-CB 3.32Å; I882-F885 PolarHBondContact O-N 3.37Å; Q883-F885 VanDerWaalsContact C-N 3.26Å; Q883-F885 PolarHBondContact O-N 3.41Å; F885-E887 VanDerWaalsContact C-N 3.3Å; F885-E887 PolarHBondContact O-N 3.43Å; F885-I888 PolarHBondContact O-N 3.44Å; F885-L889 HydrophobicContact CD1-CD1 4.24Å; F885-L889 HydrophobicContact CD2-CD1 4.2Å; F885-L889 HydrophobicContact CD2-CG 4.06Å; F885-L889 HydrophobicContact CE1-CD1 3.58Å; F885-L889 HydrophobicContact CE1-CG 4.46Å; F885-L889 HydrophobicContact CE2-CD1 3.57Å; F885-L889 HydrophobicContact CE2-CD2 4.22Å; F885-L889 HydrophobicContact CE2-CG 3.63Å; F885-L889 HydrophobicContact CZ-CD1 3.26Å; F885-L889 HydrophobicContact CZ-CG 3.9Å; F885-L889 PolarHBondContact O-N 3.41Å
886	C	76.7	Confident	69.6	Low	4 Å²	4	51.4 Å²	51.4	3%	0.027	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-37.6	178.5	-64.1	0	0	0	0	111.7	I882 Q883 T890 L960	I882-C886 PolarHBondContact O-N 2.87Å; I882-C886 PolarHBondContact O-SG 3.26Å; Q883-C886 PolarHBondContact O-N 3.03Å; C886-T890 VanDerWaalsContact O-CB 3.31Å; C886-T890 WeakPolarHBondContact O-CB 3.49Å; C886-T890 PolarHBondContact O-N 3.3Å; C886-T890 PolarHBondContact O-OG1 2.89Å; C886-L960 HydrophobicContact CB-CD1 3.81Å; C886-L960 WeakPolarHBondContact O-CD1 3.43Å
887	E	78.7	Confident	70.7	Confident	61 Å²	61	47 Å²	47	29%	0.285	23%	0.234	S	C	.	.	H	α-helix	trans	-65.5	-41.3	174.5	-71.6	177.1	-155.8	0	0	112.4	Q883 S884 F885 K891	Q883-E887 WeakPolarHBondContact CG-OE1 3.5Å; Q883-E887 PolarHBondContact NE2-OE1 2.92Å; Q883-E887 WeakPolarHBondContact O-CG 3.45Å; Q883-E887 PolarHBondContact O-N 3.11Å; S884-E887 PolarHBondContact O-N 2.94Å; F885-E887 VanDerWaalsContact C-N 3.3Å; F885-E887 PolarHBondContact O-N 3.43Å; E887-K891 WeakPolarHBondContact O-CD 3.27Å; E887-K891 VanDerWaalsContact O-CG 3.31Å; E887-K891 WeakPolarHBondContact O-CG 3.48Å; E887-K891 PolarHBondContact O-N 3.37Å; E887-K891 VanDerWaalsContact O-N 3.1Å
888	I	75.7	Confident	71.5	Confident	49 Å²	49	46.1 Å²	46.1	25%	0.251	24%	0.236	S	C	.	.	H	α-helix	trans	-65.1	-51.5	175.4	-69.1	164.5	0	0	0	110.3	I867 S884 F885 T890 K891 D892 L915	I867-I888 HydrophobicContact CD1-CD1 3.52Å; S884-I888 WeakPolarHBondContact O-CD1 3.13Å; S884-I888 VanDerWaalsContact O-CG1 3.25Å; S884-I888 WeakPolarHBondContact O-CG1 3.33Å; S884-I888 PolarHBondContact O-N 3.04Å; F885-I888 PolarHBondContact O-N 3.44Å; I888-T890 VanDerWaalsContact C-N 3.27Å; I888-T890 PolarHBondContact O-N 3.04Å; I888-K891 WeakPolarHBondContact O-CB 3.24Å; I888-K891 PolarHBondContact O-N 3.43Å; I888-K891 VanDerWaalsContact O-N 3.09Å; I888-D892 PolarHBondContact O-N 2.99Å; I888-L915 HydrophobicContact CG2-CD2 4.47Å
889	L	76.4	Confident	71.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.1	-40.4	176.3	-83.4	-177.1	0	0	0	112.4	F885 K891 D892 I893 L915 M956 L960	F885-L889 HydrophobicContact CD1-CD1 4.24Å; F885-L889 HydrophobicContact CD2-CD1 4.2Å; F885-L889 HydrophobicContact CD2-CG 4.06Å; F885-L889 HydrophobicContact CE1-CD1 3.58Å; F885-L889 HydrophobicContact CE1-CG 4.46Å; F885-L889 HydrophobicContact CE2-CD1 3.57Å; F885-L889 HydrophobicContact CE2-CD2 4.22Å; F885-L889 HydrophobicContact CE2-CG 3.63Å; F885-L889 HydrophobicContact CZ-CD1 3.26Å; F885-L889 HydrophobicContact CZ-CG 3.9Å; F885-L889 PolarHBondContact O-N 3.41Å; L889-K891 VanDerWaalsContact C-N 3.35Å; L889-K891 PolarHBondContact O-N 3.19Å; L889-D892 PolarHBondContact O-N 2.9Å; L889-I893 WeakPolarHBondContact O-CB 3.3Å; L889-I893 WeakPolarHBondContact O-CD1 3.18Å; L889-I893 WeakPolarHBondContact O-CG1 3.4Å; L889-I893 PolarHBondContact O-N 3.41Å; L889-L915 HydrophobicContact CD2-CD2 3.86Å; L889-M956 HydrophobicContact CD2-CB 4.27Å; L889-M956 HydrophobicContact CD2-CE 3.96Å; L889-M956 HydrophobicContact CD2-CG 4.29Å; L889-L960 HydrophobicContact CB-CB 4.47Å; L889-L960 HydrophobicContact CB-CD1 4.2Å; L889-L960 HydrophobicContact CD1-CB 4.11Å
890	T	77.4	Confident	71.2	Confident	33 Å²	33	44 Å²	44	20%	0.202	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-43.7	177.4	-60.2	0	0	0	0	111.1	C886 I888 V894 L996	C886-T890 VanDerWaalsContact O-CB 3.31Å; C886-T890 WeakPolarHBondContact O-CB 3.49Å; C886-T890 PolarHBondContact O-N 3.3Å; C886-T890 PolarHBondContact O-OG1 2.89Å; I888-T890 VanDerWaalsContact C-N 3.27Å; I888-T890 PolarHBondContact O-N 3.04Å; T890-V894 WeakPolarHBondContact O-CB 3.33Å; T890-V894 VanDerWaalsContact O-CG2 3.26Å; T890-V894 WeakPolarHBondContact O-CG2 3.43Å; T890-V894 PolarHBondContact O-N 3.1Å; T890-L996 HydrophobicContact CG2-CD1 4.16Å; T890-L996 HydrophobicContact CG2-CD2 4.46Å
891	K	78.6	Confident	70.4	Confident	104 Å²	104	39.9 Å²	39.9	45%	0.452	21%	0.208	S	C	.	.	H	α-helix	trans	-62.1	-46	175.1	-70.6	162.7	-173	164	0	111.3	E887 I888 L889 V894 Q895	E887-K891 WeakPolarHBondContact O-CD 3.27Å; E887-K891 VanDerWaalsContact O-CG 3.31Å; E887-K891 WeakPolarHBondContact O-CG 3.48Å; E887-K891 PolarHBondContact O-N 3.37Å; E887-K891 VanDerWaalsContact O-N 3.1Å; I888-K891 WeakPolarHBondContact O-CB 3.24Å; I888-K891 PolarHBondContact O-N 3.43Å; I888-K891 VanDerWaalsContact O-N 3.09Å; L889-K891 VanDerWaalsContact C-N 3.35Å; L889-K891 PolarHBondContact O-N 3.19Å; K891-V894 PolarHBondContact O-N 3.43Å; K891-Q895 WeakPolarHBondContact O-CB 3.47Å; K891-Q895 PolarHBondContact O-N 3.24Å
892	D	71.8	Confident	69.6	Low	10 Å²	10	41.6 Å²	41.6	5%	0.053	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-40.1	-177.3	-68.2	2.8	0	0	0	112.1	I888 L889 Q895 L896 N912 L915 M956	I888-D892 PolarHBondContact O-N 2.99Å; L889-D892 PolarHBondContact O-N 2.9Å; D892-Q895 PolarHBondContact O-N 3.39Å; D892-L896 WeakPolarHBondContact O-CB 3.06Å; D892-L896 WeakPolarHBondContact O-CG 3.13Å; D892-L896 PolarHBondContact O-N 2.91Å; D892-N912 PolarHBondContact OD1-ND2 3.35Å; D892-N912 PolarHBondContact OD2-ND2 3.49Å; D892-L915 WeakPolarHBondContact OD2-CD2 3.06Å; D892-M956 HydrophobicContact CB-CE 3.39Å
893	I	72.7	Confident	68.5	Low	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-41.1	173.9	-61.9	162.2	0	0	0	110.4	L889 Q895 L896 H897 M956 L957 L960 F1000	L889-I893 WeakPolarHBondContact O-CB 3.3Å; L889-I893 WeakPolarHBondContact O-CD1 3.18Å; L889-I893 WeakPolarHBondContact O-CG1 3.4Å; L889-I893 PolarHBondContact O-N 3.41Å; I893-Q895 VanDerWaalsContact C-N 3.33Å; I893-Q895 PolarHBondContact O-N 3.05Å; I893-L896 PolarHBondContact O-N 2.91Å; I893-H897 WeakPolarHBondContact O-CB 3.23Å; I893-H897 PolarHBondContact O-N 3.39Å; I893-M956 HydrophobicContact CD1-CB 3.87Å; I893-M956 HydrophobicContact CG1-CB 3.65Å; I893-M956 HydrophobicContact CG1-CE 3.84Å; I893-M956 HydrophobicContact CG1-SD 4.37Å; I893-L957 HydrophobicContact CD1-CD2 4.1Å; I893-L957 HydrophobicContact CD1-CG 4.27Å; I893-L960 HydrophobicContact CD1-CB 4.32Å; I893-L960 HydrophobicContact CD1-CD2 3.9Å; I893-F1000 HydrophobicContact CB-CE2 4.39Å; I893-F1000 HydrophobicContact CB-CZ 4.22Å; I893-F1000 HydrophobicContact CG2-CD2 4.1Å; I893-F1000 HydrophobicContact CG2-CE1 4.01Å; I893-F1000 HydrophobicContact CG2-CE2 3.5Å; I893-F1000 HydrophobicContact CG2-CZ 3.47Å; I893-F1000 VanDerWaalsContact CG2-CZ 3.47Å
894	V	73.9	Confident	66.8	Low	37 Å²	37	48.8 Å²	48.8	22%	0.224	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-40.1	173.9	169.2	0	0	0	0	111.2	T890 K891 H897 N898 F1000	T890-V894 WeakPolarHBondContact O-CB 3.33Å; T890-V894 VanDerWaalsContact O-CG2 3.26Å; T890-V894 WeakPolarHBondContact O-CG2 3.43Å; T890-V894 PolarHBondContact O-N 3.1Å; K891-V894 PolarHBondContact O-N 3.43Å; V894-H897 WeakPolarHBondContact O-CB 3.42Å; V894-H897 PolarHBondContact O-N 3.44Å; V894-N898 VanDerWaalsContact O-CG 3.24Å; V894-N898 PolarHBondContact O-N 2.95Å; V894-N898 PolarHBondContact O-ND2 2.79Å; V894-F1000 HydrophobicContact CG2-CE1 4.3Å; V894-F1000 HydrophobicContact CG2-CZ 3.75Å
895	Q	71.3	Confident	65.3	Low	79 Å²	79	51.4 Å²	51.4	37%	0.369	27%	0.272	S	S	.	.	H	α-helix	trans	-69.6	-41.9	178.5	-166	168.4	2.1	0	0	112.1	K891 D892 I893 H897 N898 N899 V911	K891-Q895 WeakPolarHBondContact O-CB 3.47Å; K891-Q895 PolarHBondContact O-N 3.24Å; D892-Q895 PolarHBondContact O-N 3.39Å; I893-Q895 VanDerWaalsContact C-N 3.33Å; I893-Q895 PolarHBondContact O-N 3.05Å; Q895-H897 PolarHBondContact O-N 2.87Å; Q895-N898 PolarHBondContact O-N 3.22Å; Q895-N899 WeakPolarHBondContact O-CB 3.46Å; Q895-N899 VanDerWaalsContact O-CG 3.31Å; Q895-N899 PolarHBondContact O-N 2.75Å; Q895-N899 PolarHBondContact O-OD1 2.78Å; Q895-V911 HydrophobicContact CB-CG1 4.46Å; Q895-V911 HydrophobicContact CG-CG1 3.92Å; Q895-V911 HydrophobicContact CG-CG2 4.47Å
896	L	67.1	Low	63.7	Low	8 Å²	8	59.1 Å²	59.1	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-25.9	170.2	-72.9	172	0	0	0	113.1	D892 I893 V900 I908 L952 R953 M956	D892-L896 WeakPolarHBondContact O-CB 3.06Å; D892-L896 WeakPolarHBondContact O-CG 3.13Å; D892-L896 PolarHBondContact O-N 2.91Å; I893-L896 PolarHBondContact O-N 2.91Å; L896-V900 VanDerWaalsContact O-CG2 3.31Å; L896-V900 WeakPolarHBondContact O-CG2 2.95Å; L896-I908 HydrophobicContact CD2-CG2 3.93Å; L896-L952 HydrophobicContact CD1-CD2 3.98Å; L896-L952 HydrophobicContact CD1-CG 4.34Å; L896-L952 HydrophobicContact CD2-CD2 4.49Å; L896-R953 PolarHBondContact O-NH2 2.88Å; L896-M956 HydrophobicContact CD1-CE 3.92Å; L896-M956 HydrophobicContact CD1-SD 3.31Å; L896-M956 WeakPolarHBondContact CD1-SD 3.42Å
897	H	65.9	Low	62	Low	21 Å²	21	62.9 Å²	62.9	10%	0.097	33%	0.33	C	S	.	.	H	α-helix	trans	-70.2	-48.7	170.7	-169.7	76.4	0	0	0	110.7	I893 V894 Q895 N901 F1000	I893-H897 WeakPolarHBondContact O-CB 3.23Å; I893-H897 PolarHBondContact O-N 3.39Å; V894-H897 WeakPolarHBondContact O-CB 3.42Å; V894-H897 PolarHBondContact O-N 3.44Å; Q895-H897 PolarHBondContact O-N 2.87Å; H897-N901 PolarHBondContact O-ND2 2.6Å; H897-N901 PolarHBondContact O-OD1 3.42Å; H897-F1000 HydrophobicContact CB-CD1 4.08Å; H897-F1000 HydrophobicContact CB-CE1 3.71Å; H897-F1000 AromaticContact CG-CD1 3.79Å; H897-F1000 AromaticContact CG-CE1 3.84Å; H897-F1000 AromaticContact ND1-CD1 3.69Å
898	N	69.5	Low	60.3	Low	82 Å²	82	60.9 Å²	60.9	44%	0.439	32%	0.321	S	S	.	.	H	α-helix	trans	-68.2	-41	-178.9	-65.9	-21.4	0	0	0	113.3	V894 Q895 V900 N901	V894-N898 VanDerWaalsContact O-CG 3.24Å; V894-N898 PolarHBondContact O-N 2.95Å; V894-N898 PolarHBondContact O-ND2 2.79Å; Q895-N898 PolarHBondContact O-N 3.22Å; N898-V900 PolarHBondContact O-N 2.93Å; N898-N901 WeakPolarHBondContact O-CB 3.2Å; N898-N901 PolarHBondContact O-N 3.24Å
899	N	60.5	Low	58.6	Low	31 Å²	31	62 Å²	62	17%	0.166	32%	0.324	C	S	.	.	H	α-helix	trans	-68.2	-34.6	-176.1	-74.3	5.1	0	0	0	113	Q895 N901 N902 I908	Q895-N899 WeakPolarHBondContact O-CB 3.46Å; Q895-N899 VanDerWaalsContact O-CG 3.31Å; Q895-N899 PolarHBondContact O-N 2.75Å; Q895-N899 PolarHBondContact O-OD1 2.78Å; N899-N901 PolarHBondContact O-N 3.47Å; N899-N902 PolarHBondContact O-N 2.92Å; N899-N902 VanDerWaalsContact O-N 3.14Å; N899-I908 HydrophobicContact CB-CG1 4.23Å
900	V	57.3	Low	57	Low	42 Å²	42	69.7 Å²	69.7	26%	0.255	36%	0.36	S	S	.	.	H	α-helix	trans	-66.5	-26.9	175	168.9	0	0	0	0	111.9	L896 N898 N902 I908 P949 R953	L896-V900 VanDerWaalsContact O-CG2 3.31Å; L896-V900 WeakPolarHBondContact O-CG2 2.95Å; N898-V900 PolarHBondContact O-N 2.93Å; V900-N902 PolarHBondContact O-N 3.08Å; V900-I908 HydrophobicContact CG2-CD1 3.91Å; V900-P949 HydrophobicContact CG2-CB 4.29Å; V900-R953 VanDerWaalsContact CG2-NH2 3.33Å
901	N	51.5	Low	55.5	Low	58 Å²	58	69.3 Å²	69.3	31%	0.31	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-13	175.7	-60.1	-19.5	0	0	0	112.9	H897 N898 N899 F1007	H897-N901 PolarHBondContact O-ND2 2.6Å; H897-N901 PolarHBondContact O-OD1 3.42Å; N898-N901 WeakPolarHBondContact O-CB 3.2Å; N898-N901 PolarHBondContact O-N 3.24Å; N899-N901 PolarHBondContact O-N 3.47Å; N901-F1007 HydrophobicContact CB-CE2 3.91Å; N901-F1007 HydrophobicContact CB-CZ 3.99Å
902	N	48.3	Very low	53.9	Low	114 Å²	114	68 Å²	68	61%	0.61	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	5.5	-175.1	-75.6	-9.4	0	0	0	114.4	N899 V900 N904	N899-N902 PolarHBondContact O-N 2.92Å; N899-N902 VanDerWaalsContact O-N 3.14Å; V900-N902 PolarHBondContact O-N 3.08Å; N902-N904 PolarHBondContact O-N 2.75Å
903	N	44.8	Very low	52.6	Low	136 Å²	136	71.8 Å²	71.8	73%	0.727	38%	0.376	S	S	*	.			trans	56.1	-2.4	-178.4	-76.6	-17.5	0	0	0	117.5	T905	N903-T905 VanDerWaalsContact C-N 3.3Å; N903-T905 PolarHBondContact O-N 2.76Å
904	N	40.5	Very low	51.5	Low	94 Å²	94	78.7 Å²	78.7	50%	0.503	41%	0.406	S	S	.	.			trans	-74.2	78.5	173.7	-79.6	13.8	0	0	0	111.3	N902 M906 D907	N902-N904 PolarHBondContact O-N 2.75Å; N904-M906 PolarHBondContact O-N 2.99Å; N904-M906 VanDerWaalsContact O-N 3.17Å; N904-D907 HydrophobicContact CB-CB 4.21Å; N904-D907 WeakPolarHBondContact CB-OD2 3.46Å; N904-D907 PolarHBondContact ND2-OD2 3.37Å; N904-D907 PolarHBondContact O-N 3.49Å
905	T	40.5	Very low	50.3	Low	107 Å²	107	78 Å²	78	66%	0.656	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.8	179.3	49	0	0	0	0	114.2	N903	N903-T905 VanDerWaalsContact C-N 3.3Å; N903-T905 PolarHBondContact O-N 2.76Å
906	M	38.1	Very low	49.1	Very low	170 Å²	170	75.1 Å²	75.1	84%	0.837	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-30.6	174.6	-77.6	-156.9	164.8	0	0	114.5	N904 I908	N904-M906 PolarHBondContact O-N 2.99Å; N904-M906 VanDerWaalsContact O-N 3.17Å; M906-I908 VanDerWaalsContact C-N 3.29Å; M906-I908 PolarHBondContact O-N 3.44Å
907	D	41.8	Very low	48.1	Very low	83 Å²	83	76.4 Å²	76.4	44%	0.444	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-76.8	-18.3	-177.9	-68.9	-37.1	0	0	0	112.9	N904 F909 H910	N904-D907 HydrophobicContact CB-CB 4.21Å; N904-D907 WeakPolarHBondContact CB-OD2 3.46Å; N904-D907 PolarHBondContact ND2-OD2 3.37Å; N904-D907 PolarHBondContact O-N 3.49Å; D907-F909 PolarHBondContact O-N 3.37Å; D907-H910 PolarHBondContact O-N 2.79Å
908	I	43.7	Very low	47.2	Very low	18 Å²	18	76.6 Å²	76.6	9%	0.092	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-60.1	-28.3	-179.7	-63	175.6	0	0	0	111.8	L896 N899 V900 M906	L896-I908 HydrophobicContact CD2-CG2 3.93Å; N899-I908 HydrophobicContact CB-CG1 4.23Å; V900-I908 HydrophobicContact CG2-CD1 3.91Å; M906-I908 VanDerWaalsContact C-N 3.29Å; M906-I908 PolarHBondContact O-N 3.44Å
909	F	39.8	Very low	46.1	Very low	74 Å²	74	72.9 Å²	72.9	33%	0.325	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-93	-14	-178.2	-72.4	-80.5	0	0	0	114.6	D907 P946	D907-F909 PolarHBondContact O-N 3.37Å; F909-P946 HydrophobicContact CE1-CB 3.99Å; F909-P946 HydrophobicContact CE2-CB 3.68Å; F909-P946 HydrophobicContact CE2-CG 4.49Å; F909-P946 HydrophobicContact CZ-CB 3.28Å; F909-P946 HydrophobicContact CZ-CG 4.48Å
910	H	42.3	Very low	45.2	Very low	160 Å²	160	73.3 Å²	73.3	74%	0.741	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-14.2	177.7	-110.3	-72.3	0	0	0	113.6	D907	D907-H910 PolarHBondContact O-N 2.79Å
911	V	45.5	Very low	44.5	Very low	26 Å²	26	80.5 Å²	80.5	16%	0.158	41%	0.411	C	S	.	.	S	Bend	trans	-85.5	116.1	177.6	174.9	0	0	0	0	110.5	Q895 N913	Q895-V911 HydrophobicContact CB-CG1 4.46Å; Q895-V911 HydrophobicContact CG-CG1 3.92Å; Q895-V911 HydrophobicContact CG-CG2 4.47Å; V911-N913 VanDerWaalsContact C-N 3.34Å; V911-N913 PolarHBondContact O-N 2.91Å
912	N	45.3	Very low	44	Very low	75 Å²	75	82.5 Å²	82.5	40%	0.401	42%	0.419	S	S	.	.	S	Bend	trans	48.9	46.5	178.1	-77.3	-2	0	0	0	115.9	D892 K914 L915 T916	D892-N912 PolarHBondContact OD1-ND2 3.35Å; D892-N912 PolarHBondContact OD2-ND2 3.49Å; N912-K914 PolarHBondContact O-N 3.14Å; N912-L915 PolarHBondContact O-N 2.73Å; N912-T916 PolarHBondContact O-N 3.1Å; N912-T916 VanDerWaalsContact O-N 3.11Å; N912-T916 PolarHBondContact O-OG1 2.85Å
913	N	44.6	Very low	43.5	Very low	91 Å²	91	80.6 Å²	80.6	49%	0.487	40%	0.403	S	S	.	.	H	α-helix	trans	-49.9	-22.9	175.6	-145.6	-11	0	0	0	114.2	V911 S917	V911-N913 VanDerWaalsContact C-N 3.34Å; V911-N913 PolarHBondContact O-N 2.91Å; N913-S917 WeakPolarHBondContact O-CB 3.46Å; N913-S917 PolarHBondContact O-N 2.92Å; N913-S917 VanDerWaalsContact O-N 3.15Å; N913-S917 PolarHBondContact O-OG 3.43Å
914	K	49	Very low	43	Very low	147 Å²	147	76.5 Å²	76.5	64%	0.639	39%	0.385	S	S	*	.	H	α-helix	trans	-73	-47.4	171.9	-73.7	-172.9	177	-176	0	114	N912 S917 A918	N912-K914 PolarHBondContact O-N 3.14Å; K914-S917 PolarHBondContact O-OG 3.34Å; K914-A918 VanDerWaalsContact O-CB 3.3Å; K914-A918 WeakPolarHBondContact O-CB 3.48Å; K914-A918 PolarHBondContact O-N 3.45Å; K914-A918 VanDerWaalsContact O-N 3.08Å
915	L	49.3	Very low	42.7	Very low	22 Å²	22	77.5 Å²	77.5	12%	0.115	40%	0.399	C	S	.	.	H	α-helix	trans	-73.3	-43.5	-178.3	-170.9	67.6	0	0	0	110.2	I888 L889 D892 N912 A918 I919	I888-L915 HydrophobicContact CG2-CD2 4.47Å; L889-L915 HydrophobicContact CD2-CD2 3.86Å; D892-L915 WeakPolarHBondContact OD2-CD2 3.06Å; N912-L915 PolarHBondContact O-N 2.73Å; L915-A918 PolarHBondContact O-N 3.49Å; L915-I919 HydrophobicContact CD1-CD1 4.44Å; L915-I919 HydrophobicContact CG-CD1 4.01Å; L915-I919 WeakPolarHBondContact O-CB 3.39Å; L915-I919 WeakPolarHBondContact O-CG1 3.23Å; L915-I919 PolarHBondContact O-N 3.15Å
916	T	46.6	Very low	42.3	Very low	18 Å²	18	76.9 Å²	76.9	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-61.3	-45	176	-53.6	0	0	0	0	111.6	N912 I919 C920 L952	N912-T916 PolarHBondContact O-N 3.1Å; N912-T916 VanDerWaalsContact O-N 3.11Å; N912-T916 PolarHBondContact O-OG1 2.85Å; T916-I919 PolarHBondContact O-N 3.14Å; T916-C920 VanDerWaalsContact O-CB 3.27Å; T916-C920 WeakPolarHBondContact O-CB 3.46Å; T916-C920 PolarHBondContact O-N 3.43Å; T916-C920 PolarHBondContact O-SG 2.84Å; T916-L952 HydrophobicContact CG2-CD1 4.17Å; T916-L952 HydrophobicContact CG2-CD2 3.81Å
917	S	44.2	Very low	41.8	Very low	36 Å²	36	72.6 Å²	72.6	25%	0.252	40%	0.399	S	S	.	.	H	α-helix	trans	-69.5	-32.2	177	62.5	0	0	0	0	113.5	N913 K914 R921	N913-S917 WeakPolarHBondContact O-CB 3.46Å; N913-S917 PolarHBondContact O-N 2.92Å; N913-S917 VanDerWaalsContact O-N 3.15Å; N913-S917 PolarHBondContact O-OG 3.43Å; K914-S917 PolarHBondContact O-OG 3.34Å; S917-R921 WeakPolarHBondContact O-CB 3.19Å; S917-R921 VanDerWaalsContact O-CG 3.24Å; S917-R921 WeakPolarHBondContact O-CG 3.4Å; S917-R921 PolarHBondContact O-N 3.32Å
918	A	48	Very low	41.3	Very low	24 Å²	24	73 Å²	73	20%	0.198	41%	0.414	C	S	.	.	H	α-helix	trans	-67.7	-45.7	175	0	0	0	0	0	111.5	P864 K914 L915 R921	P864-A918 HydrophobicContact CB-CB 4.08Å; K914-A918 VanDerWaalsContact O-CB 3.3Å; K914-A918 WeakPolarHBondContact O-CB 3.48Å; K914-A918 PolarHBondContact O-N 3.45Å; K914-A918 VanDerWaalsContact O-N 3.08Å; L915-A918 PolarHBondContact O-N 3.49Å; A918-R921 PolarHBondContact O-N 3.43Å
919	I	47.5	Very low	40.6	Very low	4 Å²	4	77.6 Å²	77.6	2%	0.021	45%	0.448	C	S	.	.	H	α-helix	trans	-61.3	-47.2	172.9	-69	170.3	0	0	0	110.6	P864 L915 T916 R921 E922 Y923 L952 I955 M956 Y959	P864-I919 HydrophobicContact CG-CG1 4.31Å; L915-I919 HydrophobicContact CD1-CD1 4.44Å; L915-I919 HydrophobicContact CG-CD1 4.01Å; L915-I919 WeakPolarHBondContact O-CB 3.39Å; L915-I919 WeakPolarHBondContact O-CG1 3.23Å; L915-I919 PolarHBondContact O-N 3.15Å; T916-I919 PolarHBondContact O-N 3.14Å; I919-R921 VanDerWaalsContact C-N 3.34Å; I919-R921 PolarHBondContact O-N 3.42Å; I919-E922 PolarHBondContact O-N 3.41Å; I919-Y923 HydrophobicContact CG2-CD2 4.45Å; I919-Y923 HydrophobicContact CG2-CE2 4.49Å; I919-Y923 WeakPolarHBondContact O-CD2 3.47Å; I919-L952 HydrophobicContact CG2-CD1 4.49Å; I919-I955 HydrophobicContact CG2-CG2 3.5Å; I919-M956 HydrophobicContact CD1-CG 4.23Å; I919-Y959 HydrophobicContact CD1-CD2 4.42Å; I919-Y959 HydrophobicContact CD1-CE2 4.46Å; I919-Y959 HydrophobicContact CG1-CE2 4.18Å; I919-Y959 HydrophobicContact CG2-CE2 4.18Å
920	C	39.9	Very low	40.2	Very low	41 Å²	41	79.6 Å²	79.6	28%	0.277	47%	0.471	S	S	.	.	H	α-helix	trans	-66.2	-31.8	-178.5	-72	0	0	0	0	113.7	T916 E922 Y923 S924	T916-C920 VanDerWaalsContact O-CB 3.27Å; T916-C920 WeakPolarHBondContact O-CB 3.46Å; T916-C920 PolarHBondContact O-N 3.43Å; T916-C920 PolarHBondContact O-SG 2.84Å; C920-E922 VanDerWaalsContact C-N 3.33Å; C920-E922 PolarHBondContact O-N 3.06Å; C920-Y923 PolarHBondContact O-N 3.27Å; C920-S924 PolarHBondContact O-N 3Å; C920-S924 VanDerWaalsContact O-N 3.16Å
921	R	42.4	Very low	39.5	Very low	192 Å²	192	80.1 Å²	80.1	73%	0.725	48%	0.478	S	S	*	.	H	α-helix	trans	-63.5	-33.8	175.9	-82.8	171.8	179.9	149.3	0.1	113.3	S917 A918 I919 Y923	S917-R921 WeakPolarHBondContact O-CB 3.19Å; S917-R921 VanDerWaalsContact O-CG 3.24Å; S917-R921 WeakPolarHBondContact O-CG 3.4Å; S917-R921 PolarHBondContact O-N 3.32Å; A918-R921 PolarHBondContact O-N 3.43Å; I919-R921 VanDerWaalsContact C-N 3.34Å; I919-R921 PolarHBondContact O-N 3.42Å; R921-Y923 VanDerWaalsContact C-N 3.29Å; R921-Y923 PolarHBondContact O-N 2.79Å
922	E	40.9	Very low	38.7	Very low	101 Å²	101	87.9 Å²	87.9	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-72.4	-21.7	175.9	-67.5	-172	155.5	0	0	113	I919 C920 Y959	I919-E922 PolarHBondContact O-N 3.41Å; C920-E922 VanDerWaalsContact C-N 3.33Å; C920-E922 PolarHBondContact O-N 3.06Å; E922-Y959 PolarHBondContact OE2-OH 2.84Å
923	Y	38.4	Very low	37.8	Very low	74 Å²	74	89.1 Å²	89.1	29%	0.29	53%	0.527	S	S	.	.	H	α-helix	trans	-98	-11.2	-179.5	-78.8	-83.6	0	0	0	114.7	S716 I919 C920 R921 I955	S716-Y923 PolarHBondContact OG-OH 3.27Å; I919-Y923 HydrophobicContact CG2-CD2 4.45Å; I919-Y923 HydrophobicContact CG2-CE2 4.49Å; I919-Y923 WeakPolarHBondContact O-CD2 3.47Å; C920-Y923 PolarHBondContact O-N 3.27Å; R921-Y923 VanDerWaalsContact C-N 3.29Å; R921-Y923 PolarHBondContact O-N 2.79Å; Y923-I955 HydrophobicContact CD2-CD1 4.1Å; Y923-I955 HydrophobicContact CE1-CD1 4.4Å; Y923-I955 HydrophobicContact CE2-CD1 3.98Å; Y923-I955 HydrophobicContact CE2-CG1 4.21Å; Y923-I955 HydrophobicContact CE2-CG2 3.72Å; Y923-I955 HydrophobicContact CG-CD1 4.39Å
924	S	34.4	Very low	37.1	Very low	49 Å²	49	93.6 Å²	93.6	34%	0.343	55%	0.545	S	S	.	.			trans	-98.1	83.3	172.7	-162	0	0	0	0	110.3	C920 S926	C920-S924 PolarHBondContact O-N 3Å; C920-S924 VanDerWaalsContact O-N 3.16Å; S924-S926 VanDerWaalsContact C-N 3.31Å; S924-S926 PolarHBondContact O-N 3.05Å
925	S	34.2	Very low	36.1	Very low	115 Å²	115	95.8 Å²	95.8	80%	0.804	56%	0.557	S	S	*	*			trans	-79.8	73.3	-177.7	62.5	0	0	0	0	112.2
926	S	32	Very low	35.1	Very low	95 Å²	95	100.5 Å²	100.5	66%	0.664	59%	0.587	S	S	*	*			trans	-120.5	124.7	158.3	60.6	0	0	0	0	108.1	S924	S924-S926 VanDerWaalsContact C-N 3.31Å; S924-S926 PolarHBondContact O-N 3.05Å
927	G	29	Very low	34.2	Very low	79 Å²	79	107.6 Å²	107.6	81%	0.814	62%	0.624	S	S	*	*			trans	-80.2	-155.4	-163	0	0	0	0	0	116.5
928	A	29.8	Very low	33.5	Very low	93 Å²	93	113.1 Å²	113.1	77%	0.769	65%	0.65	S	S	*	*			trans	80.3	89.6	178.3	0	0	0	0	0	117.1
929	S	29	Very low	32.4	Very low	114 Å²	114	120.3 Å²	120.3	80%	0.797	69%	0.685	S	S	*	*				54.7	144	110.4	-53	0	0	0	0	122.1
930	S	30.9	Very low	31.6	Very low	116 Å²	116	124.2 Å²	124.2	81%	0.811	71%	0.713	S	S	*	*			trans	97.5	113.9	151.7	-50.5	0	0	0	0	117.2	Q932	S930-Q932 PolarHBondContact O-N 3.06Å
931	L	27.7	Very low	31	Very low	170 Å²	170	130.5 Å²	130.5	89%	0.89	74%	0.744	S	S	*	*			trans	-51.2	125.3	151.1	-67.8	99	0	0	0	109.7
932	Q	29.8	Very low	30.2	Very low	189 Å²	189	126.6 Å²	126.6	88%	0.883	75%	0.746	S	S	*	*				-170.3	134.5	119.9	-103	161.8	3.8	0	0	111.1	S930	S930-Q932 PolarHBondContact O-N 3.06Å
933	S	26.5	Very low	29.8	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	77%	0.766	S	S	*	*			trans	-64.2	129.6	163.9	49.4	0	0	0	0	110.1
934	H	28.4	Very low	29.7	Very low	185 Å²	185	135 Å²	135	86%	0.856	78%	0.784	S	S	*	*			trans	-162.4	140.8	135.9	-97	-63.8	0	0	0	110.4
935	H	28.7	Very low	29.8	Very low	193 Å²	193	137.9 Å²	137.9	89%	0.894	80%	0.802	S	S	*	*			trans	-72.5	121.5	172	-77.3	-101.6	0	0	0	110.4
936	T	28.3	Very low	30.3	Very low	120 Å²	120	136.6 Å²	136.6	74%	0.736	79%	0.791	S	S	*	*			trans	-152.1	134.7	153.8	37.1	0	0	0	0	110.2	L938	T936-L938 PolarHBondContact O-N 3.24Å
937	D	27.1	Very low	31.4	Very low	167 Å²	167	134.4 Å²	134.4	89%	0.893	78%	0.775	S	S	*	*			trans	-67.5	127.2	175.2	-60.8	-72	0	0	0	111.4
938	L	30.6	Very low	33	Very low	153 Å²	153	134.7 Å²	134.7	80%	0.801	76%	0.757	S	S	*	*			trans	-133.8	100.8	169.4	-79.7	174.8	0	0	0	111.6	T936 S940	T936-L938 PolarHBondContact O-N 3.24Å; L938-S940 PolarHBondContact O-N 2.8Å
939	N	25.2	Very low	34.6	Very low	174 Å²	174	132.4 Å²	132.4	93%	0.93	74%	0.735	S	S	*	*			trans	-70.1	107.8	160	-87.5	-44.4	0	0	0	109.8
940	S	29.5	Very low	36.2	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	72%	0.716	S	S	*	*			trans	-159.9	85.4	163.9	60.5	0	0	0	0	115	L938 S942	L938-S940 PolarHBondContact O-N 2.8Å; S940-S942 PolarHBondContact O-N 2.97Å
941	N	27.2	Very low	37.9	Very low	172 Å²	172	130 Å²	130	92%	0.92	70%	0.699	S	S	*	*			trans	34.9	55.7	134	-65	-20.6	0	0	0	120.7
942	S	26.6	Very low	39.9	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	66%	0.659	S	S	*	*			trans	-129.8	80.4	154.2	52	0	0	0	0	110.7	S940 E944	S940-S942 PolarHBondContact O-N 2.97Å; S942-E944 PolarHBondContact O-N 3.27Å
943	K	32.1	Very low	41.9	Very low	204 Å²	204	115.1 Å²	115.1	89%	0.887	62%	0.624	S	S	*	*			trans	-76.9	89.4	174	-73.1	-176.2	177.6	178.6	0	110.1
944	E	36	Very low	44.1	Very low	146 Å²	146	111.5 Å²	111.5	68%	0.682	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-57	137	153.6	-72.6	-162	139.1	0	0	108.5	S942	S942-E944 PolarHBondContact O-N 3.27Å
945	P	37.4	Very low	46.2	Very low	110 Å²	110	103.3 Å²	103.3	71%	0.714	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-63.8	139.8	177.4	26.7	-33.3	0	0	0	109.6
946	P	44.8	Very low	48.5	Very low	88 Å²	88	94.3 Å²	94.3	57%	0.571	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-53	137.5	175.6	18.1	-29.6	0	0	0	110.8	F909 D948	F909-P946 HydrophobicContact CE1-CB 3.99Å; F909-P946 HydrophobicContact CE2-CB 3.68Å; F909-P946 HydrophobicContact CE2-CG 4.49Å; F909-P946 HydrophobicContact CZ-CB 3.28Å; F909-P946 HydrophobicContact CZ-CG 4.48Å; P946-D948 PolarHBondContact O-N 3.47Å
947	P	55.5	Low	51	Low	50 Å²	50	89.1 Å²	89.1	33%	0.325	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-60.1	137.8	-179.1	25.2	-34.4	0	0	0	110.3
948	D	60.8	Low	53.7	Low	84 Å²	84	81.4 Å²	81.4	45%	0.449	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-48.6	123	177	166.4	18.1	0	0	0	110	P946 N950 K951 L952	P946-D948 PolarHBondContact O-N 3.47Å; D948-N950 PolarHBondContact O-N 2.84Å; D948-N950 VanDerWaalsContact O-N 3.08Å; D948-N950 WeakPolarHBondContact OD1-CB 3.27Å; D948-N950 PolarHBondContact OD1-N 2.85Å; D948-N950 PolarHBondContact OD1-ND2 3.29Å; D948-K951 HydrophobicContact CB-CB 4.02Å; D948-K951 WeakPolarHBondContact O-CA 3.37Å; D948-K951 WeakPolarHBondContact O-CB 3.44Å; D948-K951 PolarHBondContact O-N 2.84Å; D948-L952 PolarHBondContact O-N 3.12Å
949	P	63.7	Low	56.1	Low	46 Å²	46	74.3 Å²	74.3	30%	0.299	41%	0.405	S	S	.	.	H	α-helix	trans	-57.7	-26.4	-179.1	22.4	-33.8	0	0	0	112.5	V900 R953	V900-P949 HydrophobicContact CG2-CB 4.29Å; P949-R953 WeakPolarHBondContact O-CB 3.13Å; P949-R953 WeakPolarHBondContact O-CD 3.4Å; P949-R953 WeakPolarHBondContact O-CG 3.43Å; P949-R953 PolarHBondContact O-N 2.62Å
950	N	63.8	Low	58.9	Low	73 Å²	73	66 Å²	66	39%	0.39	36%	0.361	S	S	.	.	H	α-helix	trans	-73.4	-37.4	173.5	-60.4	-53.2	0	0	0	112.4	D948 R953 I954	D948-N950 PolarHBondContact O-N 2.84Å; D948-N950 VanDerWaalsContact O-N 3.08Å; D948-N950 WeakPolarHBondContact OD1-CB 3.27Å; D948-N950 PolarHBondContact OD1-N 2.85Å; D948-N950 PolarHBondContact OD1-ND2 3.29Å; N950-R953 PolarHBondContact O-N 3.36Å; N950-R953 PolarHBondContact OD1-NH1 2.87Å; N950-I954 VanDerWaalsContact O-CG1 3.3Å; N950-I954 WeakPolarHBondContact O-CG1 3.38Å; N950-I954 PolarHBondContact O-N 3.09Å
951	K	66.3	Low	61.6	Low	107 Å²	107	62 Å²	62	47%	0.465	33%	0.333	S	S	.	.	H	α-helix	trans	-61.8	-44.8	170.9	-172	179.9	178.3	-175.9	0	111.1	D948 I954 I955	D948-K951 HydrophobicContact CB-CB 4.02Å; D948-K951 WeakPolarHBondContact O-CA 3.37Å; D948-K951 WeakPolarHBondContact O-CB 3.44Å; D948-K951 PolarHBondContact O-N 2.84Å; K951-I954 PolarHBondContact O-N 2.76Å; K951-I955 HydrophobicContact CG-CD1 4.11Å; K951-I955 WeakPolarHBondContact O-CG1 3.49Å; K951-I955 PolarHBondContact O-N 3.39Å
952	L	68.6	Low	64.3	Low	8 Å²	8	53.9 Å²	53.9	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-45.9	176.4	-176.7	63.9	0	0	0	111.9	L896 T916 I919 D948 I954 I955 M956	L896-L952 HydrophobicContact CD1-CD2 3.98Å; L896-L952 HydrophobicContact CD1-CG 4.34Å; L896-L952 HydrophobicContact CD2-CD2 4.49Å; T916-L952 HydrophobicContact CG2-CD1 4.17Å; T916-L952 HydrophobicContact CG2-CD2 3.81Å; I919-L952 HydrophobicContact CG2-CD1 4.49Å; D948-L952 PolarHBondContact O-N 3.12Å; L952-I954 PolarHBondContact O-N 2.74Å; L952-I955 PolarHBondContact O-N 2.93Å; L952-M956 HydrophobicContact CD1-CG 4.49Å; L952-M956 HydrophobicContact CD1-SD 4.34Å; L952-M956 HydrophobicContact CG-SD 4.02Å; L952-M956 WeakPolarHBondContact O-CG 3.25Å; L952-M956 PolarHBondContact O-N 3.25Å
953	R	72	Confident	67	Low	38 Å²	38	48.6 Å²	48.6	14%	0.143	25%	0.252	C	S	.	.	H	α-helix	trans	-56.4	-45.3	174.1	-75.6	161.8	173.7	-173.6	-8.4	112.6	L896 V900 P949 N950 M956 L957	L896-R953 PolarHBondContact O-NH2 2.88Å; V900-R953 VanDerWaalsContact CG2-NH2 3.33Å; P949-R953 WeakPolarHBondContact O-CB 3.13Å; P949-R953 WeakPolarHBondContact O-CD 3.4Å; P949-R953 WeakPolarHBondContact O-CG 3.43Å; P949-R953 PolarHBondContact O-N 2.62Å; N950-R953 PolarHBondContact O-N 3.36Å; N950-R953 PolarHBondContact OD1-NH1 2.87Å; R953-M956 PolarHBondContact O-N 2.88Å; R953-L957 WeakPolarHBondContact O-CB 3.25Å; R953-L957 VanDerWaalsContact O-CG 3.32Å; R953-L957 WeakPolarHBondContact O-CG 3.5Å; R953-L957 PolarHBondContact O-N 3.24Å
954	I	73.2	Confident	69.6	Low	25 Å²	25	41 Å²	41	13%	0.128	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-46.7	177.6	-70.5	168.5	0	0	0	110.2	N503 D505 N950 K951 L952 M956 L957 Q958	N503-I954 HydrophobicContact CB-CD1 3.91Å; D505-I954 HydrophobicContact CB-CG2 4.25Å; N950-I954 VanDerWaalsContact O-CG1 3.3Å; N950-I954 WeakPolarHBondContact O-CG1 3.38Å; N950-I954 PolarHBondContact O-N 3.09Å; K951-I954 PolarHBondContact O-N 2.76Å; L952-I954 PolarHBondContact O-N 2.74Å; I954-M956 PolarHBondContact O-N 3.33Å; I954-L957 PolarHBondContact O-N 3.33Å; I954-Q958 HydrophobicContact CG2-CG 4.47Å; I954-Q958 VanDerWaalsContact O-CG 3.29Å; I954-Q958 WeakPolarHBondContact O-CG 3.15Å; I954-Q958 PolarHBondContact O-N 2.69Å
955	I	73.7	Confident	72.1	Confident	14 Å²	14	34 Å²	34	7%	0.072	19%	0.187	C	C	.	.	H	α-helix	trans	-59.3	-46.8	178.4	-67.9	164	0	0	0	110.9	I919 Y923 K951 L952 L957 Q958 Y959	I919-I955 HydrophobicContact CG2-CG2 3.5Å; Y923-I955 HydrophobicContact CD2-CD1 4.1Å; Y923-I955 HydrophobicContact CE1-CD1 4.4Å; Y923-I955 HydrophobicContact CE2-CD1 3.98Å; Y923-I955 HydrophobicContact CE2-CG1 4.21Å; Y923-I955 HydrophobicContact CE2-CG2 3.72Å; Y923-I955 HydrophobicContact CG-CD1 4.39Å; K951-I955 HydrophobicContact CG-CD1 4.11Å; K951-I955 WeakPolarHBondContact O-CG1 3.49Å; K951-I955 PolarHBondContact O-N 3.39Å; L952-I955 PolarHBondContact O-N 2.93Å; I955-L957 PolarHBondContact O-N 3.47Å; I955-Q958 WeakPolarHBondContact O-CB 3.44Å; I955-Q958 PolarHBondContact O-N 2.99Å; I955-Q958 VanDerWaalsContact O-N 3.13Å; I955-Y959 HydrophobicContact CG2-CD2 3.79Å; I955-Y959 HydrophobicContact CG2-CE2 3.5Å; I955-Y959 VanDerWaalsContact CG2-CE2 3.5Å; I955-Y959 VanDerWaalsContact O-CD2 3.25Å; I955-Y959 WeakPolarHBondContact O-CD2 3.28Å; I955-Y959 PolarHBondContact O-N 3.32Å
956	M	76.1	Confident	74.4	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-37.4	177.6	-67.7	171.8	75.8	0	0	112.8	L889 D892 I893 L896 I919 L952 R953 I954 Q958 Y959 L960	L889-M956 HydrophobicContact CD2-CB 4.27Å; L889-M956 HydrophobicContact CD2-CE 3.96Å; L889-M956 HydrophobicContact CD2-CG 4.29Å; D892-M956 HydrophobicContact CB-CE 3.39Å; I893-M956 HydrophobicContact CD1-CB 3.87Å; I893-M956 HydrophobicContact CG1-CB 3.65Å; I893-M956 HydrophobicContact CG1-CE 3.84Å; I893-M956 HydrophobicContact CG1-SD 4.37Å; L896-M956 HydrophobicContact CD1-CE 3.92Å; L896-M956 HydrophobicContact CD1-SD 3.31Å; L896-M956 WeakPolarHBondContact CD1-SD 3.42Å; I919-M956 HydrophobicContact CD1-CG 4.23Å; L952-M956 HydrophobicContact CD1-CG 4.49Å; L952-M956 HydrophobicContact CD1-SD 4.34Å; L952-M956 HydrophobicContact CG-SD 4.02Å; L952-M956 WeakPolarHBondContact O-CG 3.25Å; L952-M956 PolarHBondContact O-N 3.25Å; R953-M956 PolarHBondContact O-N 2.88Å; I954-M956 PolarHBondContact O-N 3.33Å; M956-Q958 VanDerWaalsContact C-N 3.34Å; M956-Y959 PolarHBondContact O-N 2.94Å; M956-L960 WeakPolarHBondContact O-CB 3.19Å; M956-L960 PolarHBondContact O-N 2.91Å
957	L	81	Confident	76.3	Confident	12 Å²	12	26.1 Å²	26.1	6%	0.063	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-37.9	171.8	-76.2	167.5	0	0	0	111.9	L509 I893 R953 I954 I955 L960 I961 F997 F1000	L509-L957 HydrophobicContact CD1-CB 3.99Å; I893-L957 HydrophobicContact CD1-CD2 4.1Å; I893-L957 HydrophobicContact CD1-CG 4.27Å; R953-L957 WeakPolarHBondContact O-CB 3.25Å; R953-L957 VanDerWaalsContact O-CG 3.32Å; R953-L957 WeakPolarHBondContact O-CG 3.5Å; R953-L957 PolarHBondContact O-N 3.24Å; I954-L957 PolarHBondContact O-N 3.33Å; I955-L957 PolarHBondContact O-N 3.47Å; L957-L960 PolarHBondContact O-N 3.49Å; L957-I961 WeakPolarHBondContact O-CB 3.35Å; L957-I961 WeakPolarHBondContact O-CD1 3.3Å; L957-I961 WeakPolarHBondContact O-CG1 3.42Å; L957-I961 PolarHBondContact O-N 3.44Å; L957-F997 HydrophobicContact CD1-CD2 4.41Å; L957-F997 HydrophobicContact CD1-CE2 4.49Å; L957-F1000 HydrophobicContact CD2-CD2 4.22Å
958	Q	83	Confident	77.9	Confident	4 Å²	4	24 Å²	24	2%	0.019	12%	0.121	C	C	.	.	H	α-helix	trans	-62.2	-47.3	174.6	-65.2	164.8	-13.6	0	0	111.4	L509 L713 I717 I954 I955 M956 I961 A962	L509-Q958 HydrophobicContact CD1-CG 3.87Å; L509-Q958 HydrophobicContact CD2-CG 4.04Å; L509-Q958 HydrophobicContact CG-CG 4.21Å; L713-Q958 HydrophobicContact CD2-CB 3.99Å; L713-Q958 HydrophobicContact CD2-CG 4.32Å; I717-Q958 HydrophobicContact CD1-CB 3.52Å; I717-Q958 HydrophobicContact CD1-CG 4.48Å; I954-Q958 HydrophobicContact CG2-CG 4.47Å; I954-Q958 VanDerWaalsContact O-CG 3.29Å; I954-Q958 WeakPolarHBondContact O-CG 3.15Å; I954-Q958 PolarHBondContact O-N 2.69Å; I955-Q958 WeakPolarHBondContact O-CB 3.44Å; I955-Q958 PolarHBondContact O-N 2.99Å; I955-Q958 VanDerWaalsContact O-N 3.13Å; M956-Q958 VanDerWaalsContact C-N 3.34Å; Q958-I961 PolarHBondContact O-N 3.46Å; Q958-A962 WeakPolarHBondContact O-CB 3.23Å; Q958-A962 PolarHBondContact O-N 3.29Å
959	Y	81.4	Confident	79.3	Confident	4 Å²	4	20 Å²	20	2%	0.016	10%	0.1	C	C	.	.	H	α-helix	trans	-64.6	-39.9	176.6	-75.4	-72.6	0	0	0	112.5	I717 F863 I919 E922 I955 M956 A962 G963	I717-Y959 HydrophobicContact CG1-CD1 4.34Å; I717-Y959 HydrophobicContact CG1-CE1 4.08Å; F863-Y959 AromaticContact CD1-CD1 3.56Å; F863-Y959 HydrophobicContact CD1-CD1 3.56Å; F863-Y959 HydrophobicContact CD1-CE1 4.05Å; F863-Y959 AromaticContact CE1-CD1 3.93Å; F863-Y959 HydrophobicContact CE1-CD1 3.93Å; I919-Y959 HydrophobicContact CD1-CD2 4.42Å; I919-Y959 HydrophobicContact CD1-CE2 4.46Å; I919-Y959 HydrophobicContact CG1-CE2 4.18Å; I919-Y959 HydrophobicContact CG2-CE2 4.18Å; E922-Y959 PolarHBondContact OE2-OH 2.84Å; I955-Y959 HydrophobicContact CG2-CD2 3.79Å; I955-Y959 HydrophobicContact CG2-CE2 3.5Å; I955-Y959 VanDerWaalsContact CG2-CE2 3.5Å; I955-Y959 VanDerWaalsContact O-CD2 3.25Å; I955-Y959 WeakPolarHBondContact O-CD2 3.28Å; I955-Y959 PolarHBondContact O-N 3.32Å; M956-Y959 PolarHBondContact O-N 2.94Å; Y959-A962 PolarHBondContact O-N 3.31Å; Y959-G963 PolarHBondContact O-N 2.9Å
960	L	83.6	Confident	80.4	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-62.2	-45.5	176.5	179.5	63.3	0	0	0	111.4	C886 L889 I893 M956 L957 G963 H964 L996	C886-L960 HydrophobicContact CB-CD1 3.81Å; C886-L960 WeakPolarHBondContact O-CD1 3.43Å; L889-L960 HydrophobicContact CB-CB 4.47Å; L889-L960 HydrophobicContact CB-CD1 4.2Å; L889-L960 HydrophobicContact CD1-CB 4.11Å; I893-L960 HydrophobicContact CD1-CB 4.32Å; I893-L960 HydrophobicContact CD1-CD2 3.9Å; M956-L960 WeakPolarHBondContact O-CB 3.19Å; M956-L960 PolarHBondContact O-N 2.91Å; L957-L960 PolarHBondContact O-N 3.49Å; L960-G963 PolarHBondContact O-N 3.11Å; L960-H964 PolarHBondContact O-CD2 2.96Å; L960-H964 PolarHBondContact O-N 3.47Å; L960-L996 HydrophobicContact CD2-CD2 3.58Å
961	I	86.7	Confident	81.6	Confident	3 Å²	3	20 Å²	20	2%	0.015	10%	0.1	C	C	.	.	H	α-helix	trans	-63.9	-44	176.2	-70.6	166.3	0	0	0	110.3	L509 L512 L513 L957 Q958 G963 H964 F965 I993	L509-I961 HydrophobicContact CD1-CD1 4.14Å; L509-I961 HydrophobicContact CD2-CD1 3.8Å; L509-I961 HydrophobicContact CG-CD1 4.39Å; L512-I961 HydrophobicContact CD2-CG2 3.68Å; L513-I961 HydrophobicContact CD1-CD1 4.06Å; L513-I961 HydrophobicContact CD2-CD1 4.44Å; L513-I961 HydrophobicContact CG-CD1 4.38Å; L957-I961 WeakPolarHBondContact O-CB 3.35Å; L957-I961 WeakPolarHBondContact O-CD1 3.3Å; L957-I961 WeakPolarHBondContact O-CG1 3.42Å; L957-I961 PolarHBondContact O-N 3.44Å; Q958-I961 PolarHBondContact O-N 3.46Å; I961-G963 PolarHBondContact O-N 2.81Å; I961-H964 PolarHBondContact O-N 2.99Å; I961-F965 HydrophobicContact CG2-CD2 3.79Å; I961-F965 HydrophobicContact CG2-CE2 3.93Å; I961-F965 WeakPolarHBondContact O-CD2 3.46Å; I961-F965 PolarHBondContact O-N 2.81Å; I961-I993 HydrophobicContact CG1-CG2 4.13Å
962	A	84.7	Confident	82.8	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-58.1	-47.9	176	0	0	0	0	0	112.1	L713 I717 I859 F863 Q958 Y959 F965 A966	L713-A962 HydrophobicContact CD1-CB 3.76Å; I717-A962 HydrophobicContact CG2-CB 4.04Å; I859-A962 HydrophobicContact CG2-CB 4.21Å; F863-A962 HydrophobicContact CE1-CB 4.2Å; F863-A962 HydrophobicContact CZ-CB 4.29Å; Q958-A962 WeakPolarHBondContact O-CB 3.23Å; Q958-A962 PolarHBondContact O-N 3.29Å; Y959-A962 PolarHBondContact O-N 3.31Å; A962-F965 PolarHBondContact O-N 2.93Å; A962-A966 VanDerWaalsContact O-CB 3.3Å; A962-A966 WeakPolarHBondContact O-CB 3.5Å; A962-A966 PolarHBondContact O-N 3.25Å
963	G	82.2	Confident	83.7	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-59.8	-47.7	177.7	0	0	0	0	0	112.8	Y959 L960 I961 F965 A966 M967	Y959-G963 PolarHBondContact O-N 2.9Å; L960-G963 PolarHBondContact O-N 3.11Å; I961-G963 PolarHBondContact O-N 2.81Å; G963-F965 PolarHBondContact O-N 3.44Å; G963-A966 WeakPolarHBondContact O-CB 3.23Å; G963-A966 PolarHBondContact O-N 3.13Å; G963-M967 WeakPolarHBondContact O-CG 3.3Å; G963-M967 PolarHBondContact O-N 3.42Å
964	H	87.5	Confident	84.4	Confident	44 Å²	44	15.5 Å²	15.5	20%	0.204	8%	0.084	C	C	.	.	H	α-helix	trans	-62.6	-41.9	177.2	-78.2	-56.5	0	0	0	113.5	L960 I961 A966 M967 L968 I993	L960-H964 PolarHBondContact O-CD2 2.96Å; L960-H964 PolarHBondContact O-N 3.47Å; I961-H964 PolarHBondContact O-N 2.99Å; H964-A966 VanDerWaalsContact C-N 3.34Å; H964-M967 PolarHBondContact O-N 3.35Å; H964-L968 VanDerWaalsContact O-CB 3.29Å; H964-L968 WeakPolarHBondContact O-CB 3.46Å; H964-L968 PolarHBondContact O-N 3.34Å; H964-I993 HydrophobicContact CB-CD1 3.4Å; H964-I993 HydrophobicContact CB-CG1 4.43Å; H964-I993 VanDerWaalsContact CG-CD1 3.44Å
965	F	89.3	Confident	84.7	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-69.3	-33.1	174.8	-83.9	-79.9	0	0	0	112	T516 L705 V709 I859 I961 A962 G963 M967 L968 L969 L990	T516-F965 HydrophobicContact CG2-CE1 4.38Å; T516-F965 HydrophobicContact CG2-CZ 3.91Å; L705-F965 HydrophobicContact CB-CE1 4.26Å; L705-F965 HydrophobicContact CD1-CE1 4.43Å; L705-F965 HydrophobicContact CD2-CE1 4.38Å; V709-F965 HydrophobicContact CG2-CB 4.23Å; V709-F965 HydrophobicContact CG2-CD1 3.79Å; V709-F965 HydrophobicContact CG2-CD2 3.69Å; V709-F965 HydrophobicContact CG2-CE1 4Å; V709-F965 HydrophobicContact CG2-CE2 3.91Å; V709-F965 HydrophobicContact CG2-CG 3.64Å; V709-F965 HydrophobicContact CG2-CZ 4.07Å; I859-F965 HydrophobicContact CD1-CB 3.39Å; I961-F965 HydrophobicContact CG2-CD2 3.79Å; I961-F965 HydrophobicContact CG2-CE2 3.93Å; I961-F965 WeakPolarHBondContact O-CD2 3.46Å; I961-F965 PolarHBondContact O-N 2.81Å; A962-F965 PolarHBondContact O-N 2.93Å; G963-F965 PolarHBondContact O-N 3.44Å; F965-M967 VanDerWaalsContact C-N 3.3Å; F965-M967 PolarHBondContact O-N 3.45Å; F965-L968 HydrophobicContact CD1-CD2 4.12Å; F965-L968 HydrophobicContact CE1-CD2 4.2Å; F965-L968 PolarHBondContact O-N 2.97Å; F965-L969 HydrophobicContact CB-CD1 4.37Å; F965-L969 HydrophobicContact CD1-CD1 4.5Å; F965-L969 HydrophobicContact CD1-CD2 4.46Å; F965-L969 HydrophobicContact CD1-CG 4.39Å; F965-L969 WeakPolarHBondContact O-CB 3.18Å; F965-L969 VanDerWaalsContact O-CG 3.24Å; F965-L969 WeakPolarHBondContact O-CG 3.44Å; F965-L969 PolarHBondContact O-N 3.41Å; F965-L990 HydrophobicContact CE1-CD2 3.93Å; F965-L990 HydrophobicContact CE2-CD2 4.17Å; F965-L990 HydrophobicContact CZ-CD2 3.64Å
966	A	84.3	Confident	85.2	Confident	11 Å²	11	22.5 Å²	22.5	9%	0.091	12%	0.121	C	C	.	.	H	α-helix	trans	-64.1	-32.5	174.9	0	0	0	0	0	112.9	I859 T861 A962 G963 H964 P970	I859-A966 HydrophobicContact CB-CB 4.03Å; I859-A966 HydrophobicContact CG2-CB 4.25Å; T861-A966 HydrophobicContact CG2-CB 3.36Å; A962-A966 VanDerWaalsContact O-CB 3.3Å; A962-A966 WeakPolarHBondContact O-CB 3.5Å; A962-A966 PolarHBondContact O-N 3.25Å; G963-A966 WeakPolarHBondContact O-CB 3.23Å; G963-A966 PolarHBondContact O-N 3.13Å; H964-A966 VanDerWaalsContact C-N 3.34Å; A966-P970 WeakPolarHBondContact O-CD 3.39Å; A966-P970 VanDerWaalsContact O-CG 3.25Å; A966-P970 WeakPolarHBondContact O-CG 3.44Å
967	M	84.4	Confident	85.8	Confident	22 Å²	22	23.9 Å²	23.9	11%	0.108	13%	0.131	C	C	.	.	H	α-helix	trans	-75.5	-42	170.6	-62.9	166.5	70.9	0	0	112.2	H879 I882 Q883 G963 H964 F965	H879-M967 WeakPolarHBondContact CE1-CE 3.41Å; H879-M967 WeakPolarHBondContact NE2-CE 3.44Å; I882-M967 HydrophobicContact CB-CG 3.88Å; I882-M967 HydrophobicContact CB-SD 4.18Å; I882-M967 HydrophobicContact CD1-CG 4.49Å; I882-M967 HydrophobicContact CG2-CG 3.56Å; I882-M967 HydrophobicContact CG2-SD 3.8Å; Q883-M967 HydrophobicContact CB-CE 3.64Å; Q883-M967 HydrophobicContact CB-SD 4.39Å; Q883-M967 HydrophobicContact CG-CE 4.26Å; G963-M967 WeakPolarHBondContact O-CG 3.3Å; G963-M967 PolarHBondContact O-N 3.42Å; H964-M967 PolarHBondContact O-N 3.35Å; F965-M967 VanDerWaalsContact C-N 3.3Å; F965-M967 PolarHBondContact O-N 3.45Å
968	L	89.9	Confident	86.1	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-69.3	-45.9	-172.8	177.9	65.6	0	0	0	113.7	H964 F965 E971 C972 L981 I986 R989 L990	H964-L968 VanDerWaalsContact O-CB 3.29Å; H964-L968 WeakPolarHBondContact O-CB 3.46Å; H964-L968 PolarHBondContact O-N 3.34Å; F965-L968 HydrophobicContact CD1-CD2 4.12Å; F965-L968 HydrophobicContact CE1-CD2 4.2Å; F965-L968 PolarHBondContact O-N 2.97Å; L968-E971 PolarHBondContact O-N 3.21Å; L968-C972 PolarHBondContact O-SG 3.35Å; L968-L981 HydrophobicContact CD1-CD1 3.75Å; L968-I986 HydrophobicContact CD1-CG1 4.39Å; L968-I986 HydrophobicContact CD1-CG2 4.33Å; L968-I986 HydrophobicContact CD2-CG2 4.22Å; L968-R989 HydrophobicContact CD1-CB 4.3Å; L968-L990 HydrophobicContact CD2-CD1 4.39Å; L968-L990 HydrophobicContact CD2-CD2 3.7Å; L968-L990 HydrophobicContact CD2-CG 4.01Å
969	L	89.4	Confident	86.4	Confident	2 Å²	2	31.5 Å²	31.5	1%	0.01	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-39.1	-168.4	-63.6	171.2	0	0	0	114.5	A702 L705 W706 I859 F965 E971 C972 W973	A702-L969 HydrophobicContact CB-CD2 4.21Å; A702-L969 WeakPolarHBondContact O-CD2 3.39Å; L705-L969 HydrophobicContact CB-CD2 3.81Å; L705-L969 HydrophobicContact CD1-CD2 4.2Å; W706-L969 HydrophobicContact CB-CD1 3.98Å; I859-L969 HydrophobicContact CD1-CD1 3.6Å; I859-L969 HydrophobicContact CG1-CD1 4.28Å; F965-L969 HydrophobicContact CB-CD1 4.37Å; F965-L969 HydrophobicContact CD1-CD1 4.5Å; F965-L969 HydrophobicContact CD1-CD2 4.46Å; F965-L969 HydrophobicContact CD1-CG 4.39Å; F965-L969 WeakPolarHBondContact O-CB 3.18Å; F965-L969 VanDerWaalsContact O-CG 3.24Å; F965-L969 WeakPolarHBondContact O-CG 3.44Å; F965-L969 PolarHBondContact O-N 3.41Å; L969-E971 VanDerWaalsContact C-N 3.26Å; L969-E971 PolarHBondContact O-N 2.89Å; L969-C972 WeakPolarHBondContact O-CB 3.46Å; L969-C972 PolarHBondContact O-N 2.96Å; L969-W973 HydrophobicContact CB-CH2 3.5Å; L969-W973 HydrophobicContact CB-CZ2 3.51Å; L969-W973 HydrophobicContact CB-CZ3 4.03Å; L969-W973 HydrophobicContact CD1-CH2 3.83Å; L969-W973 HydrophobicContact CD1-CZ3 4.37Å; L969-W973 HydrophobicContact CD2-CZ3 4.4Å; L969-W973 HydrophobicContact CG-CH2 4.16Å; L969-W973 PolarHBondContact O-N 3.04Å; L969-W973 PolarHBondContact O-NE1 3Å
970	P	87.2	Confident	87	Confident	68 Å²	68	32 Å²	32	44%	0.442	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-37.3	173.4	-29.5	37.8	0	0	0	114.8	A966 C972 T974	A966-P970 WeakPolarHBondContact O-CD 3.39Å; A966-P970 VanDerWaalsContact O-CG 3.25Å; A966-P970 WeakPolarHBondContact O-CG 3.44Å; P970-C972 VanDerWaalsContact C-N 3.28Å; P970-C972 PolarHBondContact O-N 3.4Å; P970-T974 PolarHBondContact O-N 2.99Å; P970-T974 PolarHBondContact O-OG1 3.22Å
971	E	89.7	Confident	87.4	Confident	50 Å²	50	32.3 Å²	32.3	23%	0.234	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-9.5	175.9	-62.6	-178.5	-139	0	0	113.7	H879 L968 L969 R980 L981 R989	H879-E971 IonicContact NE2-OE1 3.02Å; L968-E971 PolarHBondContact O-N 3.21Å; L969-E971 VanDerWaalsContact C-N 3.26Å; L969-E971 PolarHBondContact O-N 2.89Å; E971-R980 VanDerWaalsContact O-CA 3.32Å; E971-R980 WeakPolarHBondContact O-CA 3.47Å; E971-L981 HydrophobicContact CB-CD1 3.9Å; E971-L981 HydrophobicContact CB-CG 3.87Å; E971-L981 PolarHBondContact O-N 3.13Å; E971-L981 VanDerWaalsContact O-N 3.1Å; E971-L981 WeakPolarHBondContact OE2-CD2 3.44Å; E971-R989 VanDerWaalsContact CD-NH2 3.33Å; E971-R989 IonicContact OE1-CZ 3.06Å; E971-R989 IonicContact OE1-NH1 3.37Å; E971-R989 PolarHBondContact OE1-NH1 3.17Å; E971-R989 IonicContact OE1-NH2 2.93Å; E971-R989 PolarHBondContact OE1-NH2 3.1Å; E971-R989 IonicContact OE2-CZ 2.93Å; E971-R989 IonicContact OE2-NH1 3.34Å; E971-R989 PolarHBondContact OE2-NH1 3.28Å; E971-R989 VanDerWaalsContact OE2-NH1 3.08Å; E971-R989 IonicContact OE2-NH2 2.77Å; E971-R989 PolarHBondContact OE2-NH2 3.38Å
972	C	90.9	Very high	87.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-28.5	179.3	-60	0	0	0	0	112.4	I698 A702 L968 L969 P970 R980 I986	I698-C972 HydrophobicContact CG2-CB 4.01Å; A702-C972 HydrophobicContact CB-CB 3.51Å; L968-C972 PolarHBondContact O-SG 3.35Å; L969-C972 WeakPolarHBondContact O-CB 3.46Å; L969-C972 PolarHBondContact O-N 2.96Å; P970-C972 VanDerWaalsContact C-N 3.28Å; P970-C972 PolarHBondContact O-N 3.4Å; C972-R980 WeakPolarHBondContact O-CD 3.46Å; C972-I986 VanDerWaalsContact SG-CD1 3.59Å
973	W	88.5	Confident	88.1	Confident	15 Å²	15	35 Å²	35	6%	0.057	20%	0.2	C	C	.	.	S	Bend	trans	-115.8	22.1	-179.7	58	41.2	0	0	0	114.8	Y699 A702 L703 W706 R856 P857 L969	Y699-W973 HydrophobicContact CD2-CB 3.58Å; Y699-W973 HydrophobicContact CE2-CB 3.82Å; A702-W973 HydrophobicContact CB-CB 4.31Å; A702-W973 HydrophobicContact CB-CD2 4.16Å; A702-W973 HydrophobicContact CB-CE3 3.46Å; A702-W973 VanDerWaalsContact CB-CE3 3.46Å; A702-W973 HydrophobicContact CB-CZ3 4.08Å; L703-W973 HydrophobicContact CD2-CE3 4.13Å; L703-W973 HydrophobicContact CD2-CZ3 4.32Å; W706-W973 HydrophobicContact CB-CH2 4.16Å; W706-W973 HydrophobicContact CB-CZ3 4.01Å; W706-W973 HydrophobicContact CG-CH2 4.28Å; W706-W973 HydrophobicContact CG-CZ3 4.48Å; R856-W973 HydrophobicContact CG-CG 4.43Å; R856-W973 PolarHBondContact NE-O 3.37Å; R856-W973 VanDerWaalsContact NE-O 3.09Å; P857-W973 HydrophobicContact CB-CH2 3.97Å; P857-W973 HydrophobicContact CB-CZ3 4.27Å; P857-W973 HydrophobicContact CG-CZ3 4.37Å; P857-W973 VanDerWaalsContact O-CH2 3.31Å; P857-W973 WeakPolarHBondContact O-CH2 3.24Å; P857-W973 WeakPolarHBondContact O-CZ2 3.35Å; L969-W973 HydrophobicContact CB-CH2 3.5Å; L969-W973 HydrophobicContact CB-CZ2 3.51Å; L969-W973 HydrophobicContact CB-CZ3 4.03Å; L969-W973 HydrophobicContact CD1-CH2 3.83Å; L969-W973 HydrophobicContact CD1-CZ3 4.37Å; L969-W973 HydrophobicContact CD2-CZ3 4.4Å; L969-W973 HydrophobicContact CG-CH2 4.16Å; L969-W973 PolarHBondContact O-N 3.04Å; L969-W973 PolarHBondContact O-NE1 3Å
974	T	85.8	Confident	88.6	Confident	43 Å²	43	39.2 Å²	39.2	26%	0.264	22%	0.222	S	C	.	.			trans	-49.1	142.2	173.3	-42	0	0	0	0	111	P970 E976 R980	P970-T974 PolarHBondContact O-N 2.99Å; P970-T974 PolarHBondContact O-OG1 3.22Å; T974-E976 PolarHBondContact O-N 2.84Å; T974-R980 PolarHBondContact O-NE 3.24Å; T974-R980 PolarHBondContact O-NH2 2.94Å
975	T	78.9	Confident	88.9	Confident	80 Å²	80	44.7 Å²	44.7	49%	0.491	24%	0.241	S	C	.	.	S	Bend	trans	-58.1	-48.2	-179.9	41.5	0	0	0	0	111.4	R980	T975-R980 PolarHBondContact O-NH2 2.9Å
976	E	85.3	Confident	89.1	Confident	106 Å²	106	44.7 Å²	44.7	50%	0.495	24%	0.241	S	C	.	.	S	Bend	trans	-70.1	121.2	170.6	-174.9	177.8	-129.8	0	0	110.8	T974 D978 S979	T974-E976 PolarHBondContact O-N 2.84Å; E976-D978 HydrophobicContact CG-CB 4.48Å; E976-D978 PolarHBondContact O-N 3.18Å; E976-S979 WeakPolarHBondContact OE2-CB 3.28Å; E976-S979 PolarHBondContact OE2-OG 3.18Å
977	P	87.5	Confident	89.5	Confident	33 Å²	33	47 Å²	47	21%	0.214	25%	0.249	C	C	.	.	S	Bend	trans	-73	-27.3	-175.6	29.8	-35.4	0	0	0	112.9	K695 S979 R980	K695-P977 HydrophobicContact CB-CB 4.12Å; K695-P977 HydrophobicContact CD-CB 4.31Å; K695-P977 VanDerWaalsContact CD-O 3.3Å; K695-P977 WeakPolarHBondContact CD-O 3.45Å; K695-P977 WeakPolarHBondContact CG-O 3.47Å; P977-S979 VanDerWaalsContact C-N 3.33Å; P977-R980 WeakPolarHBondContact O-CB 3.37Å; P977-R980 PolarHBondContact O-N 3.28Å
978	D	88.5	Confident	89.8	Confident	108 Å²	108	52.6 Å²	52.6	58%	0.578	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-26.5	-177.8	-69.4	-18.8	0	0	0	112.9	K695 E976 R980	K695-D978 WeakPolarHBondContact CE-OD1 3.38Å; K695-D978 IonicContact NZ-OD1 2.98Å; K695-D978 PolarHBondContact NZ-OD1 3.25Å; E976-D978 HydrophobicContact CG-CB 4.48Å; E976-D978 PolarHBondContact O-N 3.18Å; D978-R980 VanDerWaalsContact C-N 3.29Å; D978-R980 PolarHBondContact O-N 3.27Å
979	S	88.5	Confident	89.7	Confident	68 Å²	68	56.9 Å²	56.9	48%	0.476	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.1	174.2	-74.6	0	0	0	0	113.8	E976 P977	E976-S979 WeakPolarHBondContact OE2-CB 3.28Å; E976-S979 PolarHBondContact OE2-OG 3.18Å; P977-S979 VanDerWaalsContact C-N 3.33Å
980	R	93.3	Very high	89.7	Confident	14 Å²	14	57 Å²	57	5%	0.053	29%	0.289	C	S	.	.	S	Bend	trans	-72.9	143.5	-179.1	-63.1	178.7	-167.5	149.5	15.9	112.8	E679 K695 I698 E971 C972 T974 T975 P977 D978	E679-R980 IonicContact OE1-CZ 2.68Å; E679-R980 IonicContact OE1-NH1 3.58Å; E679-R980 PolarHBondContact OE1-NH1 3.22Å; E679-R980 IonicContact OE1-NH2 3.2Å; E679-R980 IonicContact OE2-CZ 3.74Å; E679-R980 IonicContact OE2-NH1 2.64Å; E679-R980 PolarHBondContact OE2-NH1 2.82Å; E679-R980 IonicContact OE2-NH2 2.77Å; E679-R980 PolarHBondContact OE2-NH2 2.99Å; K695-R980 PolarHBondContact O-NH1 3.46Å; I698-R980 HydrophobicContact CG2-CB 4.36Å; E971-R980 VanDerWaalsContact O-CA 3.32Å; E971-R980 WeakPolarHBondContact O-CA 3.47Å; C972-R980 WeakPolarHBondContact O-CD 3.46Å; T974-R980 PolarHBondContact O-NE 3.24Å; T974-R980 PolarHBondContact O-NH2 2.94Å; T975-R980 PolarHBondContact O-NH2 2.9Å; P977-R980 WeakPolarHBondContact O-CB 3.37Å; P977-R980 PolarHBondContact O-N 3.28Å; D978-R980 VanDerWaalsContact C-N 3.29Å; D978-R980 PolarHBondContact O-N 3.27Å
981	L	92.1	Very high	89.6	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.037	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-63.4	138.3	175.7	-67.8	179.5	0	0	0	113.4	I698 L968 E971 R985 I986	I698-L981 WeakPolarHBondContact CD1-O 3.38Å; I698-L981 WeakPolarHBondContact CG1-O 3.37Å; I698-L981 VanDerWaalsContact CG2-O 3.24Å; I698-L981 WeakPolarHBondContact CG2-O 3.5Å; L968-L981 HydrophobicContact CD1-CD1 3.75Å; E971-L981 HydrophobicContact CB-CD1 3.9Å; E971-L981 HydrophobicContact CB-CG 3.87Å; E971-L981 PolarHBondContact O-N 3.13Å; E971-L981 VanDerWaalsContact O-N 3.1Å; E971-L981 WeakPolarHBondContact OE2-CD2 3.44Å; L981-R985 HydrophobicContact CB-CB 4.4Å; L981-R985 HydrophobicContact CD2-CB 4.05Å; L981-I986 HydrophobicContact CB-CD1 4.27Å; L981-I986 HydrophobicContact CB-CG1 3.79Å; L981-I986 HydrophobicContact CD1-CG1 4.15Å
982	S	93.8	Very high	89.1	Confident	58 Å²	58	57.5 Å²	57.5	41%	0.406	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-71.1	152.6	166.6	69.3	0	0	0	0	111.7	L984 R985 I986	S982-L984 PolarHBondContact O-N 3.32Å; S982-R985 WeakPolarHBondContact O-CA 3.35Å; S982-R985 WeakPolarHBondContact O-CB 3.26Å; S982-R985 PolarHBondContact O-N 3.47Å; S982-R985 PolarHBondContact OG-N 2.85Å; S982-I986 PolarHBondContact O-N 3.06Å; S982-I986 VanDerWaalsContact O-N 3.09Å
983	A	93.7	Very high	88.6	Confident	2 Å²	2	58 Å²	58	2%	0.017	29%	0.293	C	S	.	.	H	α-helix	trans	-53.5	-32.8	177.9	0	0	0	0	0	112.9	V520 L523 C524 I698 K987	V520-A983 WeakPolarHBondContact CG1-O 3.42Å; L523-A983 HydrophobicContact CD2-CB 4.39Å; L523-A983 HydrophobicContact CG-CB 4.38Å; C524-A983 HydrophobicContact CB-CB 4.07Å; I698-A983 HydrophobicContact CD1-CB 3.91Å; A983-K987 WeakPolarHBondContact O-CB 3.42Å; A983-K987 PolarHBondContact O-N 3.35Å
984	L	92.9	Very high	88.4	Confident	88 Å²	88	60.1 Å²	60.1	46%	0.461	30%	0.301	S	S	.	.	H	α-helix	trans	-67.8	-36.5	175	-178.3	61.9	0	0	0	113.1	S982 K988	S982-L984 PolarHBondContact O-N 3.32Å; L984-K988 WeakPolarHBondContact O-CG 3.42Å; L984-K988 PolarHBondContact O-N 2.95Å; L984-K988 VanDerWaalsContact O-N 3.14Å
985	R	93	Very high	88.2	Confident	159 Å²	159	61.6 Å²	61.6	60%	0.6	31%	0.306	S	S	*	.	H	α-helix	trans	-69.4	-43	174.7	-72.5	-175.7	-178.1	-175.2	2.1	111	L981 S982 K987 K988 R989	L981-R985 HydrophobicContact CB-CB 4.4Å; L981-R985 HydrophobicContact CD2-CB 4.05Å; S982-R985 WeakPolarHBondContact O-CA 3.35Å; S982-R985 WeakPolarHBondContact O-CB 3.26Å; S982-R985 PolarHBondContact O-N 3.47Å; S982-R985 PolarHBondContact OG-N 2.85Å; R985-K987 VanDerWaalsContact C-N 3.33Å; R985-K987 PolarHBondContact O-N 3.37Å; R985-K988 PolarHBondContact O-N 3.35Å; R985-R989 PolarHBondContact O-N 3.43Å
986	I	93.7	Very high	88	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.4	-47.6	174.1	-59.7	174.7	0	0	0	110	V520 I698 L701 L705 L968 C972 L981 S982 K988 R989 L990	V520-I986 HydrophobicContact CG1-CB 4.13Å; V520-I986 HydrophobicContact CG1-CG2 3.93Å; V520-I986 HydrophobicContact CG2-CG2 3.85Å; I698-I986 HydrophobicContact CD1-CD1 4.05Å; I698-I986 HydrophobicContact CG2-CD1 4.01Å; L701-I986 HydrophobicContact CD2-CD1 3.79Å; L705-I986 HydrophobicContact CD1-CG2 4.46Å; L968-I986 HydrophobicContact CD1-CG1 4.39Å; L968-I986 HydrophobicContact CD1-CG2 4.33Å; L968-I986 HydrophobicContact CD2-CG2 4.22Å; C972-I986 VanDerWaalsContact SG-CD1 3.59Å; L981-I986 HydrophobicContact CB-CD1 4.27Å; L981-I986 HydrophobicContact CB-CG1 3.79Å; L981-I986 HydrophobicContact CD1-CG1 4.15Å; S982-I986 PolarHBondContact O-N 3.06Å; S982-I986 VanDerWaalsContact O-N 3.09Å; I986-K988 VanDerWaalsContact C-N 3.34Å; I986-K988 PolarHBondContact O-N 3.37Å; I986-R989 PolarHBondContact O-N 3.26Å; I986-L990 HydrophobicContact CG2-CD1 4.12Å; I986-L990 PolarHBondContact O-N 3.28Å
987	K	92.8	Very high	87.7	Confident	60 Å²	60	53.8 Å²	53.8	26%	0.261	26%	0.264	S	S	.	.	H	α-helix	trans	-55	-48.6	176.6	-167.4	-174.3	173	-171.6	0	111.9	V520 A983 R985 R989 L990 Q991	V520-K987 HydrophobicContact CG1-CB 3.73Å; V520-K987 HydrophobicContact CG1-CG 4.39Å; A983-K987 WeakPolarHBondContact O-CB 3.42Å; A983-K987 PolarHBondContact O-N 3.35Å; R985-K987 VanDerWaalsContact C-N 3.33Å; R985-K987 PolarHBondContact O-N 3.37Å; K987-R989 VanDerWaalsContact C-N 3.35Å; K987-R989 PolarHBondContact O-N 3.23Å; K987-L990 PolarHBondContact O-N 3.45Å; K987-Q991 WeakPolarHBondContact O-CB 3.45Å; K987-Q991 PolarHBondContact O-N 3.05Å
988	K	90.8	Very high	87.1	Confident	140 Å²	140	53.9 Å²	53.9	61%	0.609	26%	0.262	S	S	*	.	H	α-helix	trans	-62.2	-39.4	-179.9	-74.7	179.7	177	-169.9	0	112.6	L984 R985 I986	L984-K988 WeakPolarHBondContact O-CG 3.42Å; L984-K988 PolarHBondContact O-N 2.95Å; L984-K988 VanDerWaalsContact O-N 3.14Å; R985-K988 PolarHBondContact O-N 3.35Å; I986-K988 VanDerWaalsContact C-N 3.34Å; I986-K988 PolarHBondContact O-N 3.37Å
989	R	87.8	Confident	86.3	Confident	93 Å²	93	53.8 Å²	53.8	35%	0.351	26%	0.257	S	S	.	.	H	α-helix	trans	-67.7	-39.6	176.5	-77.9	-173.5	169.2	-172.6	0.9	113	L968 E971 R985 I986 K987 S992	L968-R989 HydrophobicContact CD1-CB 4.3Å; E971-R989 VanDerWaalsContact CD-NH2 3.33Å; E971-R989 IonicContact OE1-CZ 3.06Å; E971-R989 IonicContact OE1-NH1 3.37Å; E971-R989 PolarHBondContact OE1-NH1 3.17Å; E971-R989 IonicContact OE1-NH2 2.93Å; E971-R989 PolarHBondContact OE1-NH2 3.1Å; E971-R989 IonicContact OE2-CZ 2.93Å; E971-R989 IonicContact OE2-NH1 3.34Å; E971-R989 PolarHBondContact OE2-NH1 3.28Å; E971-R989 VanDerWaalsContact OE2-NH1 3.08Å; E971-R989 IonicContact OE2-NH2 2.77Å; E971-R989 PolarHBondContact OE2-NH2 3.38Å; R985-R989 PolarHBondContact O-N 3.43Å; I986-R989 PolarHBondContact O-N 3.26Å; K987-R989 VanDerWaalsContact C-N 3.35Å; K987-R989 PolarHBondContact O-N 3.23Å; R989-S992 PolarHBondContact O-OG 3.48Å
990	L	88.4	Confident	85.3	Confident	6 Å²	6	51.9 Å²	51.9	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-75.8	-26.8	177.7	-67.5	178.7	0	0	0	113.2	V520 F965 L968 I986 K987 S992 I993 Y994	V520-L990 HydrophobicContact CG2-CD1 4.07Å; F965-L990 HydrophobicContact CE1-CD2 3.93Å; F965-L990 HydrophobicContact CE2-CD2 4.17Å; F965-L990 HydrophobicContact CZ-CD2 3.64Å; L968-L990 HydrophobicContact CD2-CD1 4.39Å; L968-L990 HydrophobicContact CD2-CD2 3.7Å; L968-L990 HydrophobicContact CD2-CG 4.01Å; I986-L990 HydrophobicContact CG2-CD1 4.12Å; I986-L990 PolarHBondContact O-N 3.28Å; K987-L990 PolarHBondContact O-N 3.45Å; L990-S992 PolarHBondContact O-N 2.9Å; L990-I993 HydrophobicContact CD2-CD1 4.23Å; L990-I993 PolarHBondContact O-N 2.89Å; L990-Y994 WeakPolarHBondContact O-CB 3.28Å; L990-Y994 PolarHBondContact O-N 3.25Å
991	Q	86	Confident	84	Confident	81 Å²	81	53.5 Å²	53.5	38%	0.379	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-39.2	-175.9	-179.3	172.7	-16.9	0	0	113	K987 I993 Y994 E995	K987-Q991 WeakPolarHBondContact O-CB 3.45Å; K987-Q991 PolarHBondContact O-N 3.05Å; Q991-I993 PolarHBondContact O-N 3.43Å; Q991-Y994 PolarHBondContact O-N 2.84Å; Q991-E995 HydrophobicContact CG-CG 4.36Å; Q991-E995 VanDerWaalsContact CG-OE1 3.31Å; Q991-E995 WeakPolarHBondContact CG-OE1 3.49Å; Q991-E995 PolarHBondContact NE2-OE1 3.08Å; Q991-E995 WeakPolarHBondContact O-CB 3.3Å; Q991-E995 WeakPolarHBondContact O-CG 3.42Å; Q991-E995 PolarHBondContact O-N 3.17Å
992	S	79	Confident	82.4	Confident	47 Å²	47	57 Å²	57	33%	0.329	27%	0.268	S	S	.	.	H	α-helix	trans	-62.6	-42.2	177.5	53.5	0	0	0	0	112.2	R989 L990 E995 L996	R989-S992 PolarHBondContact O-OG 3.48Å; L990-S992 PolarHBondContact O-N 2.9Å; S992-E995 PolarHBondContact O-N 3.5Å; S992-L996 VanDerWaalsContact O-CB 3.24Å; S992-L996 WeakPolarHBondContact O-CB 3.38Å; S992-L996 PolarHBondContact O-N 2.99Å
993	I	81	Confident	80.3	Confident	9 Å²	9	59.8 Å²	59.8	5%	0.046	27%	0.272	C	S	.	.	H	α-helix	trans	-65.4	-43.7	177.7	-51.1	167.5	0	0	0	110.3	L513 I961 H964 L990 Q991 L996 F997	L513-I993 HydrophobicContact CD2-CG2 4.12Å; I961-I993 HydrophobicContact CG1-CG2 4.13Å; H964-I993 HydrophobicContact CB-CD1 3.4Å; H964-I993 HydrophobicContact CB-CG1 4.43Å; H964-I993 VanDerWaalsContact CG-CD1 3.44Å; L990-I993 HydrophobicContact CD2-CD1 4.23Å; L990-I993 PolarHBondContact O-N 2.89Å; Q991-I993 PolarHBondContact O-N 3.43Å; I993-L996 PolarHBondContact O-N 3.2Å; I993-F997 WeakPolarHBondContact O-CB 3.36Å; I993-F997 PolarHBondContact O-N 2.91Å
994	Y	84	Confident	77.8	Confident	60 Å²	60	62.7 Å²	62.7	24%	0.235	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-42.8	177.5	-175.2	-93.6	0	0	0	111.9	L513 E514 N517 L990 Q991 N998	L513-Y994 HydrophobicContact CB-CD2 4.12Å; E514-Y994 WeakPolarHBondContact OE2-CE2 3.32Å; E514-Y994 PolarHBondContact OE2-OH 3.09Å; N517-Y994 HydrophobicContact CB-CD2 4.07Å; N517-Y994 HydrophobicContact CB-CE2 4.31Å; L990-Y994 WeakPolarHBondContact O-CB 3.28Å; L990-Y994 PolarHBondContact O-N 3.25Å; Q991-Y994 PolarHBondContact O-N 2.84Å; Y994-N998 WeakPolarHBondContact CD1-ND2 3.36Å; Y994-N998 WeakPolarHBondContact CE1-ND2 3.42Å; Y994-N998 VanDerWaalsContact CZ-ND2 3.27Å; Y994-N998 WeakPolarHBondContact O-CB 3.39Å; Y994-N998 PolarHBondContact O-N 3.4Å; Y994-N998 PolarHBondContact O-ND2 3.15Å
995	E	80.8	Confident	75.1	Confident	75 Å²	75	61.2 Å²	61.2	35%	0.35	28%	0.283	S	S	.	.	H	α-helix	trans	-66.5	-40.6	174.1	-74.7	177.8	-159.3	0	0	112.5	Q991 S992 K999	Q991-E995 HydrophobicContact CG-CG 4.36Å; Q991-E995 VanDerWaalsContact CG-OE1 3.31Å; Q991-E995 WeakPolarHBondContact CG-OE1 3.49Å; Q991-E995 PolarHBondContact NE2-OE1 3.08Å; Q991-E995 WeakPolarHBondContact O-CB 3.3Å; Q991-E995 WeakPolarHBondContact O-CG 3.42Å; Q991-E995 PolarHBondContact O-N 3.17Å; S992-E995 PolarHBondContact O-N 3.5Å; E995-K999 WeakPolarHBondContact O-CB 3.4Å; E995-K999 WeakPolarHBondContact O-CD 3.39Å; E995-K999 WeakPolarHBondContact O-CG 3.49Å; E995-K999 PolarHBondContact O-N 3.31Å
996	L	74.6	Confident	72.3	Confident	16 Å²	16	59.9 Å²	59.9	8%	0.084	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-50.2	175.5	-173.5	87.1	0	0	0	110.8	T890 L960 S992 I993 K999 F1000 L1035	T890-L996 HydrophobicContact CG2-CD1 4.16Å; T890-L996 HydrophobicContact CG2-CD2 4.46Å; L960-L996 HydrophobicContact CD2-CD2 3.58Å; S992-L996 VanDerWaalsContact O-CB 3.24Å; S992-L996 WeakPolarHBondContact O-CB 3.38Å; S992-L996 PolarHBondContact O-N 2.99Å; I993-L996 PolarHBondContact O-N 3.2Å; L996-K999 PolarHBondContact O-N 3.15Å; L996-F1000 HydrophobicContact CD1-CE2 3.84Å; L996-F1000 HydrophobicContact CD1-CZ 4.28Å; L996-F1000 HydrophobicContact CD2-CE2 3.91Å; L996-F1000 HydrophobicContact CG-CD2 4Å; L996-F1000 HydrophobicContact CG-CE2 3.52Å; L996-F1000 HydrophobicContact CG-CZ 4.43Å; L996-F1000 WeakPolarHBondContact O-CD2 3.45Å; L996-F1000 PolarHBondContact O-N 3.13Å; L996-L1035 HydrophobicContact CD1-CD2 4.45Å
997	F	79.1	Confident	69.2	Low	5 Å²	5	63.7 Å²	63.7	2%	0.022	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-48.2	178.2	-177.2	-93.4	0	0	0	111.8	L509 R510 L513 L957 I993 K999 F1000 M1001	L509-F997 HydrophobicContact CB-CE2 4.01Å; L509-F997 HydrophobicContact CB-CZ 4.3Å; L509-F997 HydrophobicContact CD1-CE2 4.45Å; R510-F997 HydrophobicContact CB-CE1 3.83Å; R510-F997 HydrophobicContact CB-CZ 3.88Å; R510-F997 HydrophobicContact CG-CE1 3.95Å; R510-F997 HydrophobicContact CG-CZ 4.49Å; L513-F997 HydrophobicContact CD1-CB 3.56Å; L513-F997 HydrophobicContact CD1-CD1 3.68Å; L513-F997 HydrophobicContact CD1-CD2 3.56Å; L513-F997 HydrophobicContact CD1-CE1 4.23Å; L513-F997 HydrophobicContact CD1-CE2 4.14Å; L513-F997 HydrophobicContact CD1-CG 3.3Å; L513-F997 HydrophobicContact CD1-CZ 4.44Å; L957-F997 HydrophobicContact CD1-CD2 4.41Å; L957-F997 HydrophobicContact CD1-CE2 4.49Å; I993-F997 WeakPolarHBondContact O-CB 3.36Å; I993-F997 PolarHBondContact O-N 2.91Å; F997-K999 VanDerWaalsContact C-N 3.34Å; F997-K999 PolarHBondContact O-N 3.36Å; F997-F1000 PolarHBondContact O-N 3.2Å; F997-F1000 VanDerWaalsContact O-N 3.16Å; F997-M1001 HydrophobicContact CD1-CG 3.96Å; F997-M1001 HydrophobicContact CE1-CG 3.59Å; F997-M1001 HydrophobicContact CE1-SD 4.47Å; F997-M1001 HydrophobicContact CE2-CG 4.31Å; F997-M1001 HydrophobicContact CE2-SD 4.47Å; F997-M1001 HydrophobicContact CG-CG 4.46Å; F997-M1001 HydrophobicContact CZ-CG 3.79Å; F997-M1001 HydrophobicContact CZ-SD 4.09Å; F997-M1001 WeakPolarHBondContact O-CG 3.41Å; F997-M1001 PolarHBondContact O-N 3.46Å
998	N	74.6	Confident	66.4	Low	35 Å²	35	63.3 Å²	63.3	19%	0.187	30%	0.303	C	S	.	.	H	α-helix	trans	-64.4	-36	177.9	-74.3	-32	0	0	0	112.7	Y994 F1000 M1001 N1002	Y994-N998 WeakPolarHBondContact CD1-ND2 3.36Å; Y994-N998 WeakPolarHBondContact CE1-ND2 3.42Å; Y994-N998 VanDerWaalsContact CZ-ND2 3.27Å; Y994-N998 WeakPolarHBondContact O-CB 3.39Å; Y994-N998 PolarHBondContact O-N 3.4Å; Y994-N998 PolarHBondContact O-ND2 3.15Å; N998-F1000 VanDerWaalsContact C-N 3.32Å; N998-F1000 PolarHBondContact O-N 3.44Å; N998-M1001 PolarHBondContact O-N 3.23Å; N998-N1002 VanDerWaalsContact O-CB 3.28Å; N998-N1002 WeakPolarHBondContact O-CB 3.45Å; N998-N1002 PolarHBondContact O-N 3.48Å; N998-N1002 PolarHBondContact O-OD1 2.81Å
999	K	72	Confident	63.7	Low	107 Å²	107	61.2 Å²	61.2	47%	0.465	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-41	172.8	-76.9	166.1	-176.4	170.1	0	111.6	E995 L996 F997 K1003	E995-K999 WeakPolarHBondContact O-CB 3.4Å; E995-K999 WeakPolarHBondContact O-CD 3.39Å; E995-K999 WeakPolarHBondContact O-CG 3.49Å; E995-K999 PolarHBondContact O-N 3.31Å; L996-K999 PolarHBondContact O-N 3.15Å; F997-K999 VanDerWaalsContact C-N 3.34Å; F997-K999 PolarHBondContact O-N 3.36Å; K999-K1003 WeakPolarHBondContact O-CB 3.4Å; K999-K1003 WeakPolarHBondContact O-CG 3.46Å; K999-K1003 PolarHBondContact O-N 3.38Å
1000	F	67.6	Low	61.1	Low	27 Å²	27	61.3 Å²	61.3	12%	0.118	31%	0.305	C	S	.	.	H	α-helix	trans	-70.1	-41	177.2	-71.7	-51.2	0	0	0	113.2	I893 V894 H897 L957 L996 F997 N998	I893-F1000 HydrophobicContact CB-CE2 4.39Å; I893-F1000 HydrophobicContact CB-CZ 4.22Å; I893-F1000 HydrophobicContact CG2-CD2 4.1Å; I893-F1000 HydrophobicContact CG2-CE1 4.01Å; I893-F1000 HydrophobicContact CG2-CE2 3.5Å; I893-F1000 HydrophobicContact CG2-CZ 3.47Å; I893-F1000 VanDerWaalsContact CG2-CZ 3.47Å; V894-F1000 HydrophobicContact CG2-CE1 4.3Å; V894-F1000 HydrophobicContact CG2-CZ 3.75Å; H897-F1000 HydrophobicContact CB-CD1 4.08Å; H897-F1000 HydrophobicContact CB-CE1 3.71Å; H897-F1000 AromaticContact CG-CD1 3.79Å; H897-F1000 AromaticContact CG-CE1 3.84Å; H897-F1000 AromaticContact ND1-CD1 3.69Å; L957-F1000 HydrophobicContact CD2-CD2 4.22Å; L996-F1000 HydrophobicContact CD1-CE2 3.84Å; L996-F1000 HydrophobicContact CD1-CZ 4.28Å; L996-F1000 HydrophobicContact CD2-CE2 3.91Å; L996-F1000 HydrophobicContact CG-CD2 4Å; L996-F1000 HydrophobicContact CG-CE2 3.52Å; L996-F1000 HydrophobicContact CG-CZ 4.43Å; L996-F1000 WeakPolarHBondContact O-CD2 3.45Å; L996-F1000 PolarHBondContact O-N 3.13Å; F997-F1000 PolarHBondContact O-N 3.2Å; F997-F1000 VanDerWaalsContact O-N 3.16Å; N998-F1000 VanDerWaalsContact C-N 3.32Å; N998-F1000 PolarHBondContact O-N 3.44Å
1001	M	65.5	Low	58.5	Low	48 Å²	48	63.7 Å²	63.7	24%	0.236	32%	0.32	C	S	.	.	H	α-helix	trans	-71.8	-39.7	-179.8	-65.8	-60.9	-64.5	0	0	112.9	A501 F997 N998 S1004	A501-M1001 HydrophobicContact CB-CE 3.74Å; F997-M1001 HydrophobicContact CD1-CG 3.96Å; F997-M1001 HydrophobicContact CE1-CG 3.59Å; F997-M1001 HydrophobicContact CE1-SD 4.47Å; F997-M1001 HydrophobicContact CE2-CG 4.31Å; F997-M1001 HydrophobicContact CE2-SD 4.47Å; F997-M1001 HydrophobicContact CG-CG 4.46Å; F997-M1001 HydrophobicContact CZ-CG 3.79Å; F997-M1001 HydrophobicContact CZ-SD 4.09Å; F997-M1001 WeakPolarHBondContact O-CG 3.41Å; F997-M1001 PolarHBondContact O-N 3.46Å; N998-M1001 PolarHBondContact O-N 3.23Å; M1001-S1004 PolarHBondContact O-OG 3.23Å
1002	N	59.5	Low	55.9	Low	81 Å²	81	61.7 Å²	61.7	43%	0.433	32%	0.322	S	S	.	.	H	α-helix	trans	-77.4	-30.8	-177.1	-63.3	7.9	0	0	0	112.2	N998 S1004 E1005	N998-N1002 VanDerWaalsContact O-CB 3.28Å; N998-N1002 WeakPolarHBondContact O-CB 3.45Å; N998-N1002 PolarHBondContact O-N 3.48Å; N998-N1002 PolarHBondContact O-OD1 2.81Å; N1002-S1004 VanDerWaalsContact C-N 3.26Å; N1002-S1004 PolarHBondContact O-N 2.91Å; N1002-E1005 WeakPolarHBondContact O-CB 3.45Å; N1002-E1005 PolarHBondContact O-N 3.43Å
1003	K	49.3	Very low	53.9	Low	116 Å²	116	64.9 Å²	64.9	50%	0.504	34%	0.335	S	S	.	.	H	α-helix	trans	-70.1	-18	179.3	-82.2	-167.3	168.4	-164	0	114.7	K999 E1005	K999-K1003 WeakPolarHBondContact O-CB 3.4Å; K999-K1003 WeakPolarHBondContact O-CG 3.46Å; K999-K1003 PolarHBondContact O-N 3.38Å; K1003-E1005 PolarHBondContact O-N 2.9Å
1004	S	41.6	Very low	51.7	Low	63 Å²	63	69.9 Å²	69.9	44%	0.441	36%	0.361	S	S	.	.	H	α-helix	trans	-65.6	-20.8	168.1	17.1	0	0	0	0	113.5	M1001 N1002	M1001-S1004 PolarHBondContact O-OG 3.23Å; N1002-S1004 VanDerWaalsContact C-N 3.26Å; N1002-S1004 PolarHBondContact O-N 2.91Å
1005	E	35.2	Very low	49.4	Very low	57 Å²	57	74.4 Å²	74.4	27%	0.266	39%	0.386	S	S	.	.	H	α-helix	trans	-79.9	-36.4	-175.1	-56	178.7	160.6	0	0	112.5	P497 N1002 K1003 T1008	P497-E1005 HydrophobicContact CB-CG 4.36Å; P497-E1005 WeakPolarHBondContact CB-OE1 3.46Å; N1002-E1005 WeakPolarHBondContact O-CB 3.45Å; N1002-E1005 PolarHBondContact O-N 3.43Å; K1003-E1005 PolarHBondContact O-N 2.9Å; E1005-T1008 PolarHBondContact O-OG1 3.44Å
1006	E	35.4	Very low	47.2	Very low	131 Å²	131	77.8 Å²	77.8	61%	0.612	41%	0.406	S	S	*	.	H	α-helix	trans	-66.1	-39.6	178.6	-69.6	-176.9	141.4	0	0	111.9	T1008 N1009 I1010	E1006-T1008 VanDerWaalsContact C-N 3.31Å; E1006-T1008 PolarHBondContact O-N 3.04Å; E1006-N1009 PolarHBondContact O-N 2.94Å; E1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; E1006-I1010 PolarHBondContact O-N 3.28Å
1007	F	28.4	Very low	45.1	Very low	81 Å²	81	84.6 Å²	84.6	36%	0.355	44%	0.438	S	S	.	.	H	α-helix	trans	-66.9	-30.1	-176.6	-124.1	-91.9	0	0	0	113	N901 T1011	N901-F1007 HydrophobicContact CB-CE2 3.91Å; N901-F1007 HydrophobicContact CB-CZ 3.99Å; F1007-T1011 HydrophobicContact CD1-CG2 4.15Å; F1007-T1011 WeakPolarHBondContact O-CB 3.36Å; F1007-T1011 PolarHBondContact O-N 2.83Å; F1007-T1011 PolarHBondContact O-OG1 3.1Å
1008	T	34.9	Very low	42.8	Very low	51 Å²	51	92 Å²	92	31%	0.313	48%	0.477	S	S	.	.	H	α-helix	trans	-73.6	-31.6	178.6	42.8	0	0	0	0	113.7	E1005 E1006 G1012	E1005-T1008 PolarHBondContact O-OG1 3.44Å; E1006-T1008 VanDerWaalsContact C-N 3.31Å; E1006-T1008 PolarHBondContact O-N 3.04Å; T1008-G1012 PolarHBondContact O-N 2.76Å
1009	N	32.4	Very low	40.6	Very low	96 Å²	96	94.4 Å²	94.4	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-74.7	-34	175	-69.8	-20.6	0	0	0	111.6	E1006 N1013	E1006-N1009 PolarHBondContact O-N 2.94Å; N1009-N1013 PolarHBondContact O-N 3.05Å; N1009-N1013 PolarHBondContact O-ND2 3.43Å
1010	I	34	Very low	38.6	Very low	95 Å²	95	96.1 Å²	96.1	49%	0.487	51%	0.511	S	S	.	.	H	α-helix	trans	-72.7	-45.8	177	-65.9	170	0	0	0	110.8	E1006 N1013 I1014	E1006-I1010 WeakPolarHBondContact O-CG1 3.44Å; E1006-I1010 PolarHBondContact O-N 3.28Å; I1010-N1013 PolarHBondContact O-N 3.19Å; I1010-I1014 HydrophobicContact CG2-CD1 3.55Å; I1010-I1014 HydrophobicContact CG2-CG1 4.39Å; I1010-I1014 WeakPolarHBondContact O-CB 3.27Å; I1010-I1014 VanDerWaalsContact O-CG1 3.25Å; I1010-I1014 WeakPolarHBondContact O-CG1 3.41Å; I1010-I1014 PolarHBondContact O-N 2.95Å
1011	T	34.4	Very low	36.7	Very low	56 Å²	56	104.8 Å²	104.8	34%	0.344	55%	0.545	S	S	.	.	H	α-helix	trans	-70.8	-30.3	177.9	48.7	0	0	0	0	113.7	F1007 M1015	F1007-T1011 HydrophobicContact CD1-CG2 4.15Å; F1007-T1011 WeakPolarHBondContact O-CB 3.36Å; F1007-T1011 PolarHBondContact O-N 2.83Å; F1007-T1011 PolarHBondContact O-OG1 3.1Å; T1011-M1015 PolarHBondContact O-N 3.47Å
1012	G	31.4	Very low	34.9	Very low	40 Å²	40	107 Å²	107	41%	0.412	57%	0.565	S	S	.	*	H	α-helix	trans	-65.5	-35.5	172.6	0	0	0	0	0	113.7	T1008	T1008-G1012 PolarHBondContact O-N 2.76Å
1013	N	35.6	Very low	33.3	Very low	114 Å²	114	112.9 Å²	112.9	61%	0.61	59%	0.587	S	S	*	*	H	α-helix	trans	-81.7	-38.4	177.6	-69.8	-13.9	0	0	0	112.2	N1009 I1010 M1015 N1016 E1017	N1009-N1013 PolarHBondContact O-N 3.05Å; N1009-N1013 PolarHBondContact O-ND2 3.43Å; I1010-N1013 PolarHBondContact O-N 3.19Å; N1013-M1015 VanDerWaalsContact C-N 3.26Å; N1013-M1015 PolarHBondContact O-N 3.46Å; N1013-N1016 PolarHBondContact O-N 3.43Å; N1013-N1016 VanDerWaalsContact O-N 3.08Å; N1013-E1017 PolarHBondContact O-N 3.06Å
1014	I	35.8	Very low	32.4	Very low	114 Å²	114	111.9 Å²	111.9	59%	0.585	60%	0.6	S	S	*	*	H	α-helix	trans	-64.7	-26.4	179	-71.3	172.8	0	0	0	112.7	I1010 N1016	I1010-I1014 HydrophobicContact CG2-CD1 3.55Å; I1010-I1014 HydrophobicContact CG2-CG1 4.39Å; I1010-I1014 WeakPolarHBondContact O-CB 3.27Å; I1010-I1014 VanDerWaalsContact O-CG1 3.25Å; I1010-I1014 WeakPolarHBondContact O-CG1 3.41Å; I1010-I1014 PolarHBondContact O-N 2.95Å; I1014-N1016 VanDerWaalsContact C-N 3.35Å
1015	M	34.7	Very low	31.9	Very low	155 Å²	155	116.2 Å²	116.2	76%	0.764	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-8.5	174.7	-67.7	-159.7	-161.6	0	0	114.9	T1011 N1013	T1011-M1015 PolarHBondContact O-N 3.47Å; N1013-M1015 VanDerWaalsContact C-N 3.26Å; N1013-M1015 PolarHBondContact O-N 3.46Å
1016	N	36.2	Very low	31.4	Very low	146 Å²	146	121 Å²	121	78%	0.781	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	-12.7	178.7	-89.6	-22.8	0	0	0	114.3	N1013 I1014	N1013-N1016 PolarHBondContact O-N 3.43Å; N1013-N1016 VanDerWaalsContact O-N 3.08Å; I1014-N1016 VanDerWaalsContact C-N 3.35Å
1017	E	30.3	Very low	31.1	Very low	159 Å²	159	122.2 Å²	122.2	74%	0.743	65%	0.653	S	S	*	*			trans	-116.1	61.3	178.7	-67	-168	152.8	0	0	112.3	N1013 S1019	N1013-E1017 PolarHBondContact O-N 3.06Å; E1017-S1019 PolarHBondContact O-N 2.74Å
1018	N	29.1	Very low	31	Very low	160 Å²	160	123.6 Å²	123.6	86%	0.856	67%	0.672	S	S	*	*			trans	-74.6	61.6	166.6	-102.7	-23.9	0	0	0	111.4
1019	S	29	Very low	30.8	Very low	86 Å²	86	127.5 Å²	127.5	60%	0.601	70%	0.696	S	S	*	*			trans	-159.1	129	159.7	65	0	0	0	0	112.5	E1017	E1017-S1019 PolarHBondContact O-N 2.74Å
1020	N	30.1	Very low	30.9	Very low	142 Å²	142	129.4 Å²	129.4	76%	0.759	71%	0.706	S	S	*	*			trans	79.5	109	149.9	-68.1	-27.3	0	0	0	121
1021	Y	28.6	Very low	30.9	Very low	209 Å²	209	131.3 Å²	131.3	82%	0.82	72%	0.718	S	S	*	*			trans	79.6	97.7	141.8	-76.5	-99.3	0	0	0	122.2
1022	S	27.1	Very low	31	Very low	94 Å²	94	133.5 Å²	133.5	66%	0.657	73%	0.73	S	S	*	*				38.4	133.7	122.2	71.8	0	0	0	0	123.5
1023	K	26.8	Very low	31	Very low	206 Å²	206	135.4 Å²	135.4	90%	0.896	74%	0.738	S	S	*	*			trans	71.1	96.7	148.7	-73.2	-179.2	173.5	176.8	0	119.9
1024	A	29.6	Very low	30.9	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	74%	0.736	S	S	*	*			trans	-158.2	101	136.3	0	0	0	0	0	108.6
1025	N	30.9	Very low	30.8	Very low	154 Å²	154	132.8 Å²	132.8	82%	0.824	73%	0.728	S	S	*	*				43.4	101	97.5	-72.3	-6.3	0	0	0	114.1
1026	L	25.7	Very low	30.9	Very low	157 Å²	157	128.8 Å²	128.8	82%	0.822	71%	0.712	S	S	*	*				78.8	117.5	80.4	-159.3	112.5	0	0	0	113.2
1027	I	27.2	Very low	30.8	Very low	157 Å²	157	128.5 Å²	128.5	81%	0.805	71%	0.711	S	S	*	*			trans	167.3	151.6	146.5	-89.1	155.5	0	0	0	111.1
1028	C	28.3	Very low	30.8	Very low	111 Å²	111	131.9 Å²	131.9	75%	0.75	72%	0.716	S	S	*	*			trans	82.4	47.2	172	-70.9	0	0	0	0	120.4
1029	T	28.9	Very low	30.7	Very low	133 Å²	133	130.2 Å²	130.2	82%	0.816	71%	0.712	S	S	*	*			trans	-88.7	100.6	144.8	49.7	0	0	0	0	109.7
1030	N	34.9	Very low	30.8	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	72%	0.718	S	S	*	*			trans	-163.4	-28	166.6	-99.8	-25.8	0	0	0	116.7	V1032 S1033	N1030-V1032 PolarHBondContact O-N 2.94Å; N1030-S1033 PolarHBondContact O-OG 3.22Å
1031	D	35.1	Very low	30.9	Very low	135 Å²	135	131.9 Å²	131.9	72%	0.722	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-1.7	-166.1	-66	-33.3	0	0	0	117	T1034	D1031-T1034 PolarHBondContact O-OG1 3.14Å
1032	V	36.1	Very low	31	Very low	101 Å²	101	127.7 Å²	127.7	61%	0.612	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-27	-173.9	-176.3	0	0	0	0	112.8	N1030 T1034 L1035	N1030-V1032 PolarHBondContact O-N 2.94Å; V1032-T1034 VanDerWaalsContact C-N 3.28Å; V1032-T1034 PolarHBondContact O-N 3.35Å; V1032-L1035 PolarHBondContact O-N 3.07Å
1033	S	30.5	Very low	31.2	Very low	81 Å²	81	129.6 Å²	129.6	57%	0.566	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-25.5	-178.3	56.6	0	0	0	0	113.6	N1030 L1035	N1030-S1033 PolarHBondContact O-OG 3.22Å; S1033-L1035 VanDerWaalsContact C-N 3.32Å; S1033-L1035 PolarHBondContact O-N 3.25Å
1034	T	34.8	Very low	31.5	Very low	92 Å²	92	124.9 Å²	124.9	56%	0.564	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-13.6	179.5	42	0	0	0	0	114.3	D1031 V1032	D1031-T1034 PolarHBondContact O-OG1 3.14Å; V1032-T1034 VanDerWaalsContact C-N 3.28Å; V1032-T1034 PolarHBondContact O-N 3.35Å
1035	L	33.7	Very low	31.6	Very low	80 Å²	80	126.9 Å²	126.9	42%	0.419	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.8	-30.9	-180	-150.8	76.9	0	0	0	112.7	L996 V1032 S1033 N1037	L996-L1035 HydrophobicContact CD1-CD2 4.45Å; V1032-L1035 PolarHBondContact O-N 3.07Å; S1033-L1035 VanDerWaalsContact C-N 3.32Å; S1033-L1035 PolarHBondContact O-N 3.25Å; L1035-N1037 VanDerWaalsContact C-N 3.3Å; L1035-N1037 PolarHBondContact O-N 3.38Å
1036	V	37.1	Very low	31.7	Very low	72 Å²	72	125 Å²	125	44%	0.436	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.6	-18.6	-178	-178.9	0	0	0	0	112.4
1037	N	33	Very low	32.1	Very low	140 Å²	140	122.5 Å²	122.5	75%	0.749	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	20.8	-178.2	-70.4	-18.3	0	0	0	113.8	L1035	L1035-N1037 VanDerWaalsContact C-N 3.3Å; L1035-N1037 PolarHBondContact O-N 3.38Å
1038	R	29.9	Very low	32.5	Very low	230 Å²	230	119.7 Å²	119.7	87%	0.868	67%	0.666	S	S	*	*			trans	-139	9.4	-174.6	-84.4	-169.1	173.3	178.1	0.9	116.6
1039	T	28.3	Very low	32.9	Very low	125 Å²	125	120.5 Å²	120.5	77%	0.767	66%	0.659	S	S	*	*			trans	-100.9	0	165	46.9	0	0	0	0	110.1

Retrieved 1,039 of 1,039 residues in 1131.4 ms (Link to these results)

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