A0A3Q0KQ56_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQ56, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 895 aa.

						>A0A3Q0KQ56_SCHMA|A0A3Q0KQ56
MSDLEGKVSKCDSKDPLKPNIPNGIRNAHSPPHNCSSKETGSGFMLLSVKHLSKVKRTKQQAASVDNNVSERNGAETSEILPFSNFSQADGVLVHQNTMCDNAIHDVYGSGSIEAEEFEDFDEPEDGVEMNDNGNEIRDASTLPQNCFNVRSCSVIPVPVMPSNGEDICQFHPSTNSQSFVEPLNGRFKPNNSTDKVSGKKFTSIYHDGYQQNHCLSPIAFPTFGHPRNSEYLQPFQSESIYPTYSRDPCDPVSINPIMSNIVSSSESPLHVDYCPSSKQNLNIAHHLRDQGTIPDLHGFPINSDVSYSKSLCNMVSNNYSDPPNTSNWVNLTNVLHPTYHIGLSPHSRHGSYNQPLTCLHHLHPSTTSGNTAPTVSANNHLTSDVVAIAAASLPPLQPASRFRKARIHETVEQWSYGRFSVHDCHLKAIPDWVSELQKKSFVCEKAVTTLANKRIKCLSCFIPKEDKESSMFPRATHDSAHAGASVDSHSRHAHEKVDALENELDAQSMVLSNGFAGTNLFSFWNNGLRVHSQVPFTAIHIRSSEPVYDSCGNRDNNSQDIIELECTDQSTCAVNGHYEHFDSVDPLSQRENRVQSDKIEFPDSSATPLYAPDPATAYLRRQNMGISNYVNKLSIVTELEQLCDDSAIAPLKASDMATLPKSDSTFTDSKKVSNRTSECGNSHMDEICSCKTSKTISNNAPPGSPNSSFVPNGPNQIPLELQISAEISKSRLRLLDLMPNGDNKLGRECTHILSIDPNVQRLINSEGAKLINKCESEYSFSKSNNSGGFSIKSLKNSGSNSQSCRRSKSFDDSSCISRLNRIKNNRLYNSDIVKRTWAPLTVNNMTSFGSPKGIKFPSDFAEEVEYYQNSRESSLLSDRLEARIRARGHSFDVS
					

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(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	36.9	Very low	35.9	Very low	220 Å²	220	154.5 Å²	154.5	100%	1.084	86%	0.86	S	S	*	*				0	105.5	0	-66.1	-174.5	87.8	0	0	107.9
2	S	37	Very low	35.9	Very low	119 Å²	119	155.5 Å²	155.5	83%	0.832	86%	0.862	S	S	*	*			trans	-149.3	92.8	164.8	-60.6	0	0	0	0	105.1	L4	S2-L4 PolarHBondContact O-N 3.22Å
3	D	39.8	Very low	35.6	Very low	132 Å²	132	152 Å²	152	71%	0.706	86%	0.855	S	S	*	*			trans	-62.1	126.7	176.6	-58.3	-51.8	0	0	0	109.2
4	L	39.9	Very low	35.6	Very low	179 Å²	179	155.5 Å²	155.5	94%	0.937	86%	0.857	S	S	*	*			trans	-122.9	65.5	161	-124.3	104.5	0	0	0	107.8	S2	S2-L4 PolarHBondContact O-N 3.22Å
5	E	35.5	Very low	35.1	Very low	186 Å²	186	156.5 Å²	156.5	87%	0.869	86%	0.86	S	S	*	*			trans	-81.4	125.8	157.3	-70.8	-171.3	154.2	0	0	108.3
6	G	35.1	Very low	35	Very low	68 Å²	68	152.8 Å²	152.8	70%	0.701	85%	0.846	S	S	*	*			trans	162.9	83.5	171.8	0	0	0	0	0	114.2
7	K	36.6	Very low	34.9	Very low	207 Å²	207	153.2 Å²	153.2	90%	0.9	85%	0.845	S	S	*	*			trans	-179.2	90	130.4	-97.4	166.4	-173.7	-173.2	0	110.4
8	V	34.1	Very low	34.4	Very low	154 Å²	154	155.2 Å²	155.2	93%	0.933	84%	0.844	S	S	*	*			trans	-81.8	110.2	160.7	177.5	0	0	0	0	106.9
9	S	36.8	Very low	34.6	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	84%	0.837	S	S	*	*			trans	-112.1	99.3	170.7	58.6	0	0	0	0	110.4
10	K	34.9	Very low	34.3	Very low	194 Å²	194	152.8 Å²	152.8	84%	0.843	84%	0.836	S	S	*	*			trans	35.6	117.7	142.9	-67.3	-176.5	176.3	-177.8	0	119.3
11	C	28.4	Very low	34.3	Very low	131 Å²	131	152.7 Å²	152.7	89%	0.885	83%	0.833	S	S	*	*			trans	-58.4	127.1	158.2	-48.1	0	0	0	0	111.2
12	D	36.1	Very low	34.1	Very low	166 Å²	166	147.5 Å²	147.5	89%	0.888	82%	0.816	S	S	*	*			trans	-105.3	114.2	159.1	-88.9	-41	0	0	0	108.9
13	S	31.4	Very low	33.7	Very low	110 Å²	110	149.9 Å²	149.9	77%	0.769	82%	0.819	S	S	*	*			trans	-76.9	126	170.9	61.7	0	0	0	0	110.2
14	K	36.3	Very low	33.1	Very low	201 Å²	201	147 Å²	147	87%	0.874	82%	0.82	S	S	*	*			trans	-152.8	92.8	150.6	-83.2	-152.2	176.7	-179.2	0	110.1
15	D	27.8	Very low	32.7	Very low	170 Å²	170	145.7 Å²	145.7	91%	0.909	81%	0.812	S	S	*	*			trans	-74	121	148.9	-87.2	-45.8	0	0	0	107.6
16	P	33.8	Very low	32.5	Very low	97 Å²	97	148.2 Å²	148.2	63%	0.63	81%	0.814	S	S	*	*				-147.7	145.2	122.8	26.2	-5.1	0	0	0	114.9
17	L	32.5	Very low	32.1	Very low	161 Å²	161	151.1 Å²	151.1	84%	0.843	81%	0.813	S	S	*	*			trans	74.4	102.1	153.8	-84.4	87	0	0	0	119.3	P19	L17-P19 WeakPolarHBondContact O-CD 3.39Å
18	K	26.4	Very low	31.8	Very low	189 Å²	189	145.7 Å²	145.7	82%	0.822	81%	0.807	S	S	*	*			trans	-45.8	125.6	147.7	-79.6	175.3	171.2	177.7	0	112.2
19	P	37.6	Very low	31.6	Very low	108 Å²	108	146 Å²	146	70%	0.701	80%	0.798	S	S	*	*			trans	-90.2	112.8	147	6.2	14.2	0	0	0	108	L17 I21	L17-P19 WeakPolarHBondContact O-CD 3.39Å; P19-I21 PolarHBondContact O-N 3.21Å; P19-I21 VanDerWaalsContact O-N 3.11Å
20	N	29.1	Very low	31.2	Very low	154 Å²	154	145.6 Å²	145.6	82%	0.824	80%	0.795	S	S	*	*			trans	-62.8	105.1	163.2	-84.4	-47.2	0	0	0	108.3
21	I	34.9	Very low	31	Very low	150 Å²	150	141.6 Å²	141.6	77%	0.769	79%	0.789	S	S	*	*			trans	-108.6	118.8	163.8	-60.1	178.7	0	0	0	107.5	P19	P19-I21 PolarHBondContact O-N 3.21Å; P19-I21 VanDerWaalsContact O-N 3.11Å
22	P	32.3	Very low	31.2	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	78%	0.778	S	S	*	*			trans	-74.4	131	-173	27.8	-31.7	0	0	0	112.3	G24	P22-G24 PolarHBondContact O-N 2.79Å; P22-G24 VanDerWaalsContact O-N 3.1Å
23	N	29.1	Very low	30.8	Very low	169 Å²	169	141.1 Å²	141.1	90%	0.904	78%	0.777	S	S	*	*			trans	17.5	76.8	145.2	-64.7	-19.2	0	0	0	117.2
24	G	27.6	Very low	30.8	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	78%	0.776	S	S	*	*			trans	-91.6	110.4	153.6	0	0	0	0	0	109.2	P22 R26	P22-G24 PolarHBondContact O-N 2.79Å; P22-G24 VanDerWaalsContact O-N 3.1Å; G24-R26 PolarHBondContact O-N 3.15Å
25	I	30.6	Very low	30.3	Very low	152 Å²	152	138.5 Å²	138.5	78%	0.779	77%	0.771	S	S	*	*			trans	-50.9	103.5	178.1	-59.6	160.7	0	0	0	110
26	R	30.5	Very low	30.4	Very low	240 Å²	240	135.2 Å²	135.2	91%	0.906	76%	0.762	S	S	*	*			trans	-104.3	96.5	158.9	-89.9	-172	-168.9	-171.7	4	107.8	G24 A28	G24-R26 PolarHBondContact O-N 3.15Å; R26-A28 PolarHBondContact O-N 3.14Å
27	N	26.9	Very low	30.4	Very low	128 Å²	128	135.5 Å²	135.5	68%	0.684	77%	0.766	S	S	*	*			trans	-62.7	88.1	164.2	-78.1	-5.8	0	0	0	108.9	H29	N27-H29 PolarHBondContact O-N 3.45Å; N27-H29 VanDerWaalsContact O-N 3.14Å
28	A	31.5	Very low	30.6	Very low	93 Å²	93	137.2 Å²	137.2	77%	0.769	77%	0.767	S	S	*	*			trans	-80.7	72.6	158.9	0	0	0	0	0	107.6	R26 S30	R26-A28 PolarHBondContact O-N 3.14Å; A28-S30 VanDerWaalsContact C-N 3.29Å; A28-S30 PolarHBondContact O-N 3.15Å
29	H	28.4	Very low	31	Very low	162 Å²	162	137 Å²	137	75%	0.75	77%	0.769	S	S	*	*			trans	-70.9	96.6	161.1	-87.1	-44.3	0	0	0	107.3	N27	N27-H29 PolarHBondContact O-N 3.45Å; N27-H29 VanDerWaalsContact O-N 3.14Å
30	S	28.8	Very low	31	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-49.7	121	155.6	44.6	0	0	0	0	107.9	A28	A28-S30 VanDerWaalsContact C-N 3.29Å; A28-S30 PolarHBondContact O-N 3.15Å
31	P	32.1	Very low	31.1	Very low	110 Å²	110	134.3 Å²	134.3	71%	0.714	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-58.2	131.4	179.7	-19.2	29.4	0	0	0	109.1	H33	P31-H33 PolarHBondContact O-N 3.08Å
32	P	32.4	Very low	31.1	Very low	99 Å²	99	132 Å²	132	64%	0.643	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-60.7	128.2	166.8	26.4	-30.2	0	0	0	107.1	N34	P32-N34 PolarHBondContact O-N 3.35Å
33	H	27.7	Very low	31.1	Very low	187 Å²	187	130 Å²	130	87%	0.866	77%	0.767	S	S	*	*			trans	-60	86.7	164.2	-97.2	-83.5	0	0	0	107.7	P31 C35	P31-H33 PolarHBondContact O-N 3.08Å; H33-C35 PolarHBondContact O-N 3.35Å
34	N	29.7	Very low	31.5	Very low	140 Å²	140	130.1 Å²	130.1	75%	0.749	76%	0.76	S	S	*	*			trans	-70.8	92.9	162.8	-78.4	-24.6	0	0	0	105.7	P32 S36	P32-N34 PolarHBondContact O-N 3.35Å; N34-S36 PolarHBondContact O-N 3.22Å
35	C	27.3	Very low	31.9	Very low	116 Å²	116	135.3 Å²	135.3	78%	0.784	77%	0.767	S	S	*	*			trans	-60.3	81.7	154.5	-71.8	0	0	0	0	107.1	H33 S37	H33-C35 PolarHBondContact O-N 3.35Å; C35-S37 PolarHBondContact O-N 3.36Å
36	S	29.1	Very low	32.4	Very low	102 Å²	102	135.5 Å²	135.5	71%	0.713	77%	0.769	S	S	*	*			trans	-64	94.3	157.7	170.4	0	0	0	0	105.3	N34 K38	N34-S36 PolarHBondContact O-N 3.22Å; S36-K38 PolarHBondContact O-N 3.42Å
37	S	34.9	Very low	32.8	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	77%	0.767	S	S	*	*			trans	-49.5	112.7	158.8	-64.9	0	0	0	0	105.5	C35 E39	C35-S37 PolarHBondContact O-N 3.36Å; S37-E39 PolarHBondContact O-N 3.39Å
38	K	35.6	Very low	33.5	Very low	198 Å²	198	131.3 Å²	131.3	86%	0.861	77%	0.773	S	S	*	*			trans	-56.4	91.8	174.2	-72.4	178.8	174.7	178.2	0	107	S36 T40	S36-K38 PolarHBondContact O-N 3.42Å; K38-T40 PolarHBondContact O-N 3.05Å
39	E	35.3	Very low	33.6	Very low	184 Å²	184	132.8 Å²	132.8	86%	0.86	77%	0.772	S	S	*	*			trans	-60.3	109.2	165.5	-78.5	-177.9	160.9	0	0	105.3	S37 G41	S37-E39 PolarHBondContact O-N 3.39Å; E39-G41 PolarHBondContact O-N 2.77Å
40	T	36.7	Very low	34.2	Very low	137 Å²	137	133.7 Å²	133.7	84%	0.84	77%	0.774	S	S	*	*			trans	-58.1	91.7	162.8	43.6	0	0	0	0	106.1	K38 S42	K38-T40 PolarHBondContact O-N 3.05Å; T40-S42 PolarHBondContact O-N 3.43Å
41	G	30.9	Very low	34.5	Very low	68 Å²	68	137.4 Å²	137.4	70%	0.701	78%	0.78	S	S	*	*			trans	-51.7	114.7	177.6	0	0	0	0	0	108.5	E39 G43	E39-G41 PolarHBondContact O-N 2.77Å; G41-G43 VanDerWaalsContact C-N 3.28Å; G41-G43 PolarHBondContact O-N 2.76Å
42	S	36.6	Very low	35	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	78%	0.783	S	S	*	*			trans	-61.1	94.4	169.5	167.9	0	0	0	0	107.3	T40 F44	T40-S42 PolarHBondContact O-N 3.43Å; S42-F44 WeakPolarHBondContact O-CD1 3.41Å; S42-F44 PolarHBondContact O-N 2.8Å
43	G	31.5	Very low	35.2	Very low	72 Å²	72	139.1 Å²	139.1	74%	0.742	79%	0.785	S	S	*	*			trans	-63.6	97.3	-179.7	0	0	0	0	0	110.8	G41	G41-G43 VanDerWaalsContact C-N 3.28Å; G41-G43 PolarHBondContact O-N 2.76Å
44	F	36.8	Very low	35.7	Very low	170 Å²	170	139.8 Å²	139.8	75%	0.746	79%	0.785	S	S	*	*			trans	-78.7	115.2	160.3	36.7	-92.1	0	0	0	107.8	S42 L46	S42-F44 WeakPolarHBondContact O-CD1 3.41Å; S42-F44 PolarHBondContact O-N 2.8Å; F44-L46 PolarHBondContact O-N 3.04Å
45	M	37.8	Very low	35.9	Very low	179 Å²	179	138.6 Å²	138.6	88%	0.882	78%	0.782	S	S	*	*			trans	-71.1	117.6	170.1	-86.5	-175.9	-78.2	0	0	109.3
46	L	41.1	Very low	36.3	Very low	157 Å²	157	141.9 Å²	141.9	82%	0.822	78%	0.784	S	S	*	*			trans	-83.7	111.7	168.3	-66.7	172.7	0	0	0	108.5	F44 S48	F44-L46 PolarHBondContact O-N 3.04Å; L46-S48 PolarHBondContact O-N 3.41Å
47	L	38.8	Very low	36.6	Very low	163 Å²	163	148 Å²	148	85%	0.853	79%	0.791	S	S	*	*			trans	-77.3	111.3	168.4	-72.1	108.7	0	0	0	108.9	V49	L47-V49 PolarHBondContact O-N 2.71Å
48	S	41.1	Very low	36.6	Very low	117 Å²	117	148.5 Å²	148.5	82%	0.818	79%	0.79	S	S	*	*			trans	-80.2	112.8	169.2	57	0	0	0	0	110	L46	L46-S48 PolarHBondContact O-N 3.41Å
49	V	34.1	Very low	36.4	Very low	123 Å²	123	148 Å²	148	75%	0.745	79%	0.788	S	S	*	*			trans	-84.6	111.2	170.1	-176.9	0	0	0	0	108.4	L47 H51	L47-V49 PolarHBondContact O-N 2.71Å; V49-H51 PolarHBondContact O-N 3.19Å
50	K	39.4	Very low	36.3	Very low	182 Å²	182	147.6 Å²	147.6	79%	0.791	79%	0.786	S	S	*	*			trans	-79	105.8	175.4	-166.7	173.3	-176.2	173.9	0	108.9	L52	K50-L52 PolarHBondContact O-N 2.95Å
51	H	36.5	Very low	35.9	Very low	178 Å²	178	149.2 Å²	149.2	82%	0.824	78%	0.784	S	S	*	*			trans	-64.1	104.9	169.2	-94.8	-89.3	0	0	0	109.2	V49 S53	V49-H51 PolarHBondContact O-N 3.19Å; H51-S53 PolarHBondContact O-N 3.43Å
52	L	41.4	Very low	35.8	Very low	148 Å²	148	150.7 Å²	150.7	78%	0.775	79%	0.79	S	S	*	*			trans	-71.5	84.7	167.9	-66.3	171.9	0	0	0	108	K50 K54	K50-L52 PolarHBondContact O-N 2.95Å; L52-K54 PolarHBondContact O-N 3.14Å
53	S	37.2	Very low	35.5	Very low	98 Å²	98	149.8 Å²	149.8	69%	0.685	79%	0.788	S	S	*	*			trans	-62.9	103.1	163.7	57.1	0	0	0	0	107.2	H51 V55	H51-S53 PolarHBondContact O-N 3.43Å; S53-V55 PolarHBondContact O-N 3.45Å
54	K	37.3	Very low	35.3	Very low	200 Å²	200	151 Å²	151	87%	0.87	79%	0.786	S	S	*	*			trans	-65.4	84.8	165.9	-69.7	-175.6	-179.6	178.9	0	107	L52 K56	L52-K54 PolarHBondContact O-N 3.14Å; K54-K56 VanDerWaalsContact C-N 3.25Å; K54-K56 PolarHBondContact O-N 2.88Å
55	V	35.2	Very low	35	Very low	115 Å²	115	148.1 Å²	148.1	70%	0.697	78%	0.781	S	S	*	*			trans	-63.4	100.6	161.6	174.8	0	0	0	0	104.5	S53 R57	S53-V55 PolarHBondContact O-N 3.45Å; V55-R57 PolarHBondContact O-N 3.34Å
56	K	36.1	Very low	34.6	Very low	186 Å²	186	145.7 Å²	145.7	81%	0.809	77%	0.772	S	S	*	*			trans	-55.7	99.2	167.7	-173.4	174.1	-179	177.2	0	104.7	K54 T58	K54-K56 VanDerWaalsContact C-N 3.25Å; K54-K56 PolarHBondContact O-N 2.88Å; K56-T58 PolarHBondContact O-N 3.45Å
57	R	34.6	Very low	34.1	Very low	230 Å²	230	144.6 Å²	144.6	87%	0.868	77%	0.767	S	S	*	*			trans	-60.1	94.9	166.5	-76.2	-173.2	177.6	114.4	-2.6	104.4	V55 K59	V55-R57 PolarHBondContact O-N 3.34Å; R57-K59 PolarHBondContact O-N 3Å
58	T	34	Very low	33.5	Very low	112 Å²	112	144 Å²	144	69%	0.687	77%	0.765	S	S	*	*			trans	-58.7	101.7	162.5	-43.2	0	0	0	0	103.2	K56 Q60	K56-T58 PolarHBondContact O-N 3.45Å; T58-Q60 PolarHBondContact O-N 2.75Å
59	K	32.7	Very low	33	Very low	188 Å²	188	144.5 Å²	144.5	82%	0.817	76%	0.762	S	S	*	*			trans	-63.8	81.3	168.3	-165.7	175.8	-174.9	178.7	0	103.8	R57 Q61	R57-K59 PolarHBondContact O-N 3Å; K59-Q61 PolarHBondContact O-N 2.79Å
60	Q	31.9	Very low	32.6	Very low	176 Å²	176	143.5 Å²	143.5	82%	0.822	76%	0.761	S	S	*	*			trans	-60.3	94.8	159.8	-79	-176.6	-16.6	0	0	102.7	T58 A62	T58-Q60 PolarHBondContact O-N 2.75Å; Q60-A62 PolarHBondContact O-N 3.43Å
61	Q	28.5	Very low	32.3	Very low	170 Å²	170	143.7 Å²	143.7	79%	0.794	76%	0.764	S	S	*	*			trans	-48.2	115.4	158.5	-85.6	177.8	-10.2	0	0	104.4	K59 A63	K59-Q61 PolarHBondContact O-N 2.79Å; Q61-A63 PolarHBondContact O-N 3.47Å
62	A	29.7	Very low	31.8	Very low	100 Å²	100	145.4 Å²	145.4	83%	0.826	76%	0.764	S	S	*	*			trans	-57	87.9	165.7	0	0	0	0	0	106.3	Q60 S64	Q60-A62 PolarHBondContact O-N 3.43Å; A62-S64 PolarHBondContact O-N 2.88Å
63	A	30.4	Very low	31.3	Very low	82 Å²	82	146 Å²	146	68%	0.678	77%	0.768	S	S	*	*			trans	-65.3	98.1	153.1	0	0	0	0	0	103.7	Q61 V65	Q61-A63 PolarHBondContact O-N 3.47Å; A63-V65 PolarHBondContact O-N 3.43Å
64	S	27.1	Very low	30.9	Very low	98 Å²	98	144.7 Å²	144.7	69%	0.685	77%	0.77	S	S	*	*			trans	-52.8	106.7	166.8	107.4	0	0	0	0	105.7	A62	A62-S64 PolarHBondContact O-N 2.88Å
65	V	30.7	Very low	30.4	Very low	108 Å²	108	139.7 Å²	139.7	66%	0.655	77%	0.766	S	S	*	*			trans	-112.8	95	167	177.3	0	0	0	0	103.6	A63 N67	A63-V65 PolarHBondContact O-N 3.43Å; V65-N67 PolarHBondContact O-N 2.78Å
66	D	28	Very low	30.2	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	78%	0.777	S	S	*	*			trans	-58	84	170.4	-71	-43.3	0	0	0	109.5	N68	D66-N68 PolarHBondContact O-N 3Å
67	N	30.3	Very low	29.8	Very low	135 Å²	135	140.9 Å²	140.9	72%	0.722	78%	0.776	S	S	*	*			trans	-97.2	79.9	164.8	-81.1	-15	0	0	0	108.7	V65 V69	V65-N67 PolarHBondContact O-N 2.78Å; N67-V69 VanDerWaalsContact C-N 3.31Å; N67-V69 PolarHBondContact O-N 3.38Å
68	N	26.2	Very low	29.7	Very low	150 Å²	150	135.1 Å²	135.1	80%	0.802	77%	0.771	S	S	*	*			trans	-58.5	92.3	155.9	-73.3	-63	0	0	0	108.9	D66	D66-N68 PolarHBondContact O-N 3Å
69	V	32	Very low	29.5	Very low	127 Å²	127	138.4 Å²	138.4	77%	0.77	78%	0.778	S	S	*	*			trans	-132	102.7	163.4	-178.7	0	0	0	0	109.6	N67	N67-V69 VanDerWaalsContact C-N 3.31Å; N67-V69 PolarHBondContact O-N 3.38Å
70	S	26.2	Very low	29.5	Very low	102 Å²	102	137 Å²	137	71%	0.713	78%	0.778	S	S	*	*			trans	-32.8	117.1	162.8	172.2	0	0	0	0	116.5
71	E	31.5	Very low	29.4	Very low	186 Å²	186	136.2 Å²	136.2	87%	0.869	78%	0.779	S	S	*	*			trans	-136.7	92.4	149.3	-74.2	-172.1	156.4	0	0	106.7
72	R	26.3	Very low	29.4	Very low	214 Å²	214	132.6 Å²	132.6	81%	0.808	77%	0.77	S	S	*	*				32.1	102.9	92.4	-99.6	-175.9	174.8	145.4	-0.5	113
73	N	31	Very low	29.2	Very low	160 Å²	160	137 Å²	137	86%	0.856	77%	0.771	S	S	*	*				161.9	139	119	-74.4	-29.9	0	0	0	111.9
74	G	28.8	Very low	29.1	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	78%	0.775	S	S	*	*			trans	97.2	80.9	173.6	0	0	0	0	0	112.4
75	A	26.4	Very low	29	Very low	96 Å²	96	140.9 Å²	140.9	79%	0.793	78%	0.781	S	S	*	*				43.7	88.4	64.9	0	0	0	0	0	111.6
76	E	31.6	Very low	29	Very low	196 Å²	196	145 Å²	145	92%	0.916	79%	0.791	S	S	*	*				-171.9	134.8	123.9	-98.1	166.3	-154.4	0	0	111
77	T	28.6	Very low	28.8	Very low	129 Å²	129	143.6 Å²	143.6	79%	0.791	79%	0.791	S	S	*	*			trans	-79.7	129.7	-169.5	41.9	0	0	0	0	111.9
78	S	31.5	Very low	28.6	Very low	109 Å²	109	146 Å²	146	76%	0.762	80%	0.797	S	S	*	*			trans	-139.9	92	154.2	177.7	0	0	0	0	108.9	I80	S78-I80 PolarHBondContact O-N 3.38Å
79	E	29.3	Very low	28.6	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	80%	0.797	S	S	*	*			trans	-67.9	109.6	168.7	-62.1	176.3	165	0	0	109.6
80	I	33.8	Very low	28.3	Very low	158 Å²	158	145.1 Å²	145.1	81%	0.81	80%	0.802	S	S	*	*			trans	-134.2	116.2	151.6	-58.4	-178.7	0	0	0	107.5	S78	S78-I80 PolarHBondContact O-N 3.38Å
81	L	28.5	Very low	28.4	Very low	160 Å²	160	143.9 Å²	143.9	84%	0.838	81%	0.806	S	S	*	*			trans	-65.4	157.7	-174	-78.5	155.7	0	0	0	113.7
82	P	29	Very low	28.1	Very low	93 Å²	93	140.8 Å²	140.8	60%	0.604	80%	0.799	S	S	*	*			trans	-87.2	164.6	180	37.3	-33.4	0	0	0	111.6
83	F	26	Very low	28.2	Very low	192 Å²	192	138.3 Å²	138.3	84%	0.842	80%	0.801	S	S	*	*			trans	140.4	109.3	149.1	-77.6	-64.7	0	0	0	110.8
84	S	28.5	Very low	28.1	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	80%	0.8	S	S	*	*				179.9	106.6	122.6	-77.9	0	0	0	0	109.8
85	N	25.1	Very low	28	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	80%	0.802	S	S	*	*			trans	-77.6	124.3	167.2	-70.4	-48.5	0	0	0	109.2
86	F	30.5	Very low	28	Very low	194 Å²	194	145.2 Å²	145.2	85%	0.851	80%	0.801	S	S	*	*			trans	-149.2	101.9	151.2	-76.6	-74.8	0	0	0	106.2
87	S	24.2	Very low	27.8	Very low	98 Å²	98	143 Å²	143	69%	0.685	80%	0.796	S	S	*	*				58.9	92.3	93.4	-168.1	0	0	0	0	111.7
88	Q	24.8	Very low	27.8	Very low	185 Å²	185	142.5 Å²	142.5	86%	0.864	79%	0.793	S	S	*	*				68.5	105.7	98.2	-170.3	177.4	38.2	0	0	113.2
89	A	28.1	Very low	27.8	Very low	97 Å²	97	146.1 Å²	146.1	80%	0.802	80%	0.8	S	S	*	*			trans	-178.2	130.4	138	0	0	0	0	0	110.5	G91	A89-G91 PolarHBondContact O-N 3.01Å; A89-G91 VanDerWaalsContact O-N 3.14Å
90	D	25.4	Very low	27.7	Very low	163 Å²	163	143 Å²	143	87%	0.872	80%	0.796	S	S	*	*			trans	-43.7	109.1	167.5	-82.5	-52.9	0	0	0	112.7
91	G	27.1	Very low	27.4	Very low	76 Å²	76	143 Å²	143	78%	0.784	80%	0.798	S	S	*	*			trans	-106	71.6	167.4	0	0	0	0	0	110.1	A89 L93	A89-G91 PolarHBondContact O-N 3.01Å; A89-G91 VanDerWaalsContact O-N 3.14Å; G91-L93 VanDerWaalsContact C-N 3.27Å; G91-L93 PolarHBondContact O-N 2.84Å
92	V	25.6	Very low	27.7	Very low	121 Å²	121	142.7 Å²	142.7	73%	0.733	80%	0.797	S	S	*	*			trans	-70.2	86.9	167.4	179.8	0	0	0	0	108.2
93	L	29	Very low	27.7	Very low	161 Å²	161	142 Å²	142	84%	0.843	80%	0.8	S	S	*	*			trans	-135.9	100.1	154.8	-79.9	177	0	0	0	107.6	G91 H95	G91-L93 VanDerWaalsContact C-N 3.27Å; G91-L93 PolarHBondContact O-N 2.84Å; L93-H95 VanDerWaalsContact C-N 3.27Å; L93-H95 PolarHBondContact O-N 3.48Å
94	V	28	Very low	28	Very low	139 Å²	139	139.7 Å²	139.7	84%	0.842	80%	0.795	S	S	*	*			trans	-56.9	93.4	166.1	177.6	0	0	0	0	107.1
95	H	26.5	Very low	28.2	Very low	165 Å²	165	142.7 Å²	142.7	76%	0.764	80%	0.796	S	S	*	*			trans	-83.1	124.6	171.3	-151.1	44.1	0	0	0	107.8	L93 N97	L93-H95 VanDerWaalsContact C-N 3.27Å; L93-H95 PolarHBondContact O-N 3.48Å; H95-N97 PolarHBondContact O-N 3.27Å
96	Q	26.5	Very low	28.7	Very low	169 Å²	169	141.6 Å²	141.6	79%	0.79	79%	0.79	S	S	*	*			trans	-59	95.6	175.9	-67.2	172	12	0	0	108.7	T98	Q96-T98 VanDerWaalsContact C-N 3.34Å; Q96-T98 PolarHBondContact O-N 3.38Å
97	N	29	Very low	29.1	Very low	149 Å²	149	138.1 Å²	138.1	80%	0.797	79%	0.785	S	S	*	*			trans	-73.6	99.5	165.7	-83.6	2	0	0	0	107.4	H95 M99	H95-N97 PolarHBondContact O-N 3.27Å; N97-M99 PolarHBondContact O-N 3.34Å
98	T	28.2	Very low	29.6	Very low	118 Å²	118	143.4 Å²	143.4	72%	0.724	79%	0.791	S	S	*	*			trans	-48.9	120.8	164.3	41.6	0	0	0	0	109.3	Q96 C100	Q96-T98 VanDerWaalsContact C-N 3.34Å; Q96-T98 PolarHBondContact O-N 3.38Å; T98-C100 PolarHBondContact O-N 3.4Å; T98-C100 VanDerWaalsContact O-N 3.11Å
99	M	30.7	Very low	29.9	Very low	186 Å²	186	137.9 Å²	137.9	92%	0.916	78%	0.784	S	S	*	*			trans	-55	110.7	173.9	-62.1	-86.5	-136.4	0	0	108.7	N97	N97-M99 PolarHBondContact O-N 3.34Å
100	C	28.2	Very low	30.2	Very low	115 Å²	115	138.6 Å²	138.6	78%	0.777	78%	0.783	S	S	*	*			trans	-80.5	122.4	164.8	-72.5	0	0	0	0	108.4	T98 N102	T98-C100 PolarHBondContact O-N 3.4Å; T98-C100 VanDerWaalsContact O-N 3.11Å; C100-N102 PolarHBondContact O-N 3.01Å; C100-N102 VanDerWaalsContact O-N 3.1Å
101	D	27.7	Very low	30.4	Very low	158 Å²	158	134.5 Å²	134.5	85%	0.845	78%	0.779	S	S	*	*			trans	-52.8	103.8	172.2	-72.8	-50.3	0	0	0	112.1
102	N	33.6	Very low	30.9	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	78%	0.777	S	S	*	*			trans	-117.5	95.3	161.5	-90.1	14.3	0	0	0	109.4	C100	C100-N102 PolarHBondContact O-N 3.01Å; C100-N102 VanDerWaalsContact O-N 3.1Å
103	A	29.6	Very low	31.4	Very low	79 Å²	79	138.2 Å²	138.2	65%	0.653	78%	0.784	S	S	*	*			trans	31.3	98	138	0	0	0	0	0	117.5	H105	A103-H105 PolarHBondContact O-N 2.85Å
104	I	32.5	Very low	32	Very low	144 Å²	144	138.7 Å²	138.7	74%	0.738	78%	0.781	S	S	*	*				27.6	75.2	122.9	-43.9	173.4	0	0	0	113.9	D106	I104-D106 WeakPolarHBondContact CG2-OD2 3.1Å
105	H	32.3	Very low	32.7	Very low	173 Å²	173	136.5 Å²	136.5	80%	0.801	78%	0.778	S	S	*	*			trans	-104	82.2	149.2	-97.2	-67.7	0	0	0	106.9	A103 V107	A103-H105 PolarHBondContact O-N 2.85Å; H105-V107 HydrophobicContact CB-CG2 4.4Å; H105-V107 PolarHBondContact O-N 3.35Å
106	D	35.5	Very low	33.1	Very low	130 Å²	130	136.5 Å²	136.5	70%	0.695	78%	0.778	S	S	*	*			trans	-64	73.7	161.8	-70.9	-32.3	0	0	0	108.3	I104 Y108	I104-D106 WeakPolarHBondContact CG2-OD2 3.1Å; D106-Y108 PolarHBondContact O-N 3.13Å; D106-Y108 VanDerWaalsContact O-N 3.15Å
107	V	39.7	Very low	33.9	Very low	120 Å²	120	137.6 Å²	137.6	73%	0.727	78%	0.784	S	S	*	*			trans	-74.3	102.6	163.7	179	0	0	0	0	105	H105 G109	H105-V107 HydrophobicContact CB-CG2 4.4Å; H105-V107 PolarHBondContact O-N 3.35Å; V107-G109 VanDerWaalsContact C-N 3.27Å; V107-G109 PolarHBondContact O-N 3.48Å
108	Y	34.8	Very low	34.1	Very low	209 Å²	209	138.7 Å²	138.7	82%	0.82	78%	0.782	S	S	*	*			trans	-45.9	90.6	168.3	-77.9	-101.5	0	0	0	110	D106 S110	D106-Y108 PolarHBondContact O-N 3.13Å; D106-Y108 VanDerWaalsContact O-N 3.15Å; Y108-S110 PolarHBondContact O-N 3.49Å
109	G	30.8	Very low	34.9	Very low	70 Å²	70	141.4 Å²	141.4	72%	0.722	79%	0.786	S	S	*	*			trans	-67.8	101.4	169.5	0	0	0	0	0	107.3	V107 G111	V107-G109 VanDerWaalsContact C-N 3.27Å; V107-G109 PolarHBondContact O-N 3.48Å; G109-G111 VanDerWaalsContact C-N 3.32Å; G109-G111 PolarHBondContact O-N 3.17Å
110	S	34.6	Very low	36	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	78%	0.781	S	S	*	*			trans	-61.5	100.8	164	-51.5	0	0	0	0	106.1	Y108 S112	Y108-S110 PolarHBondContact O-N 3.49Å; S110-S112 PolarHBondContact O-N 2.98Å
111	G	28.5	Very low	36.7	Very low	77 Å²	77	143.7 Å²	143.7	79%	0.794	79%	0.785	S	S	*	*			trans	-60.4	100.9	177.8	0	0	0	0	0	109.2	G109 I113	G109-G111 VanDerWaalsContact C-N 3.32Å; G109-G111 PolarHBondContact O-N 3.17Å; G111-I113 PolarHBondContact O-N 2.99Å
112	S	37.1	Very low	37.8	Very low	105 Å²	105	143.7 Å²	143.7	73%	0.734	79%	0.785	S	S	*	*			trans	-67.1	110	165.7	-73.2	0	0	0	0	106.8	S110 E114	S110-S112 PolarHBondContact O-N 2.98Å; S112-E114 PolarHBondContact O-N 2.9Å
113	I	36.6	Very low	38.2	Very low	170 Å²	170	144.8 Å²	144.8	87%	0.872	79%	0.785	S	S	*	*			trans	-73.6	107.4	170.3	-162.1	163.4	0	0	0	107	G111 A115	G111-I113 PolarHBondContact O-N 2.99Å; I113-A115 PolarHBondContact O-N 3.06Å
114	E	41.4	Very low	38.9	Very low	171 Å²	171	146 Å²	146	80%	0.799	79%	0.787	S	S	*	*			trans	-76.9	119	176	-51	-166.1	-179.8	0	0	106.7	S112 E116	S112-E114 PolarHBondContact O-N 2.9Å; E114-E116 PolarHBondContact O-N 2.86Å
115	A	42.1	Very low	39.6	Very low	94 Å²	94	148.5 Å²	148.5	78%	0.777	80%	0.795	S	S	*	*			trans	-73.9	115	178.7	0	0	0	0	0	108.5	I113 E117	I113-A115 PolarHBondContact O-N 3.06Å; A115-E117 PolarHBondContact O-N 2.83Å
116	E	35.3	Very low	40.2	Very low	164 Å²	164	147.3 Å²	147.3	77%	0.766	80%	0.795	S	S	*	*			trans	-65.8	112.9	173.5	-61.9	179.1	167.3	0	0	108.9	E114 F118	E114-E116 PolarHBondContact O-N 2.86Å; E116-F118 PolarHBondContact O-N 2.89Å
117	E	42.8	Very low	40.3	Very low	193 Å²	193	144.7 Å²	144.7	90%	0.902	80%	0.799	S	S	*	*			trans	-76.5	113.2	171.2	-75	178.6	165.5	0	0	108.2	A115	A115-E117 PolarHBondContact O-N 2.83Å
118	F	33.2	Very low	40.6	Very low	171 Å²	171	144.8 Å²	144.8	75%	0.75	80%	0.799	S	S	*	*			trans	-76.2	128.5	173.8	-71.8	-93.6	0	0	0	109	E116 D120	E116-F118 PolarHBondContact O-N 2.89Å; F118-D120 PolarHBondContact O-N 3.43Å
119	E	46.3	Very low	40.9	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.822	80%	0.797	S	S	*	*			trans	-66.7	124.6	170.4	-63.4	-164.8	171.1	0	0	109.2	F121	E119-F121 PolarHBondContact O-N 3.17Å; E119-F121 VanDerWaalsContact O-N 3.13Å
120	D	52.8	Low	41.4	Very low	152 Å²	152	147.7 Å²	147.7	81%	0.813	80%	0.804	S	S	*	*			trans	-61	112.4	179.2	-68.7	-45.9	0	0	0	109.3	F118 D122	F118-D120 PolarHBondContact O-N 3.43Å; D120-D122 PolarHBondContact O-N 2.96Å
121	F	43.8	Very low	41.7	Very low	196 Å²	196	148.1 Å²	148.1	86%	0.86	80%	0.797	S	S	*	*			trans	-68.6	104.1	170.9	-73.2	-90.1	0	0	0	108.1	E119 E123	E119-F121 PolarHBondContact O-N 3.17Å; E119-F121 VanDerWaalsContact O-N 3.13Å; F121-E123 VanDerWaalsContact C-N 3.33Å; F121-E123 PolarHBondContact O-N 3.29Å
122	D	50.6	Low	42.3	Very low	159 Å²	159	152 Å²	152	85%	0.85	80%	0.8	S	S	*	*			trans	-57.7	95.8	167.2	-73.4	-42.5	0	0	0	108.7	D120	D120-D122 PolarHBondContact O-N 2.96Å
123	E	41.9	Very low	42.2	Very low	176 Å²	176	154.3 Å²	154.3	82%	0.822	80%	0.804	S	S	*	*			trans	-65.3	121.1	178.9	-165	161.1	-163.4	0	0	108.7	F121 E125	F121-E123 VanDerWaalsContact C-N 3.33Å; F121-E123 PolarHBondContact O-N 3.29Å; E123-E125 PolarHBondContact O-N 3.43Å
124	P	43.3	Very low	42.1	Very low	106 Å²	106	149.3 Å²	149.3	69%	0.688	79%	0.794	S	S	*	*			trans	-68.3	133.2	-169.9	25.1	-32.9	0	0	0	111.5	D126	P124-D126 PolarHBondContact O-N 2.91Å
125	E	48.7	Very low	41.6	Very low	195 Å²	195	147.6 Å²	147.6	91%	0.911	79%	0.791	S	S	*	*			trans	-58.1	106	172.4	-67.3	-168.5	163.1	0	0	110.1	E123 G127	E123-E125 PolarHBondContact O-N 3.43Å; E125-G127 VanDerWaalsContact C-N 3.31Å; E125-G127 PolarHBondContact O-N 2.91Å
126	D	43.3	Very low	41.2	Very low	148 Å²	148	152.2 Å²	152.2	79%	0.791	80%	0.796	S	S	*	*			trans	-65.3	91.5	169.7	-83.9	-33.9	0	0	0	109.4	P124 V128	P124-D126 PolarHBondContact O-N 2.91Å; D126-V128 VanDerWaalsContact C-N 3.27Å; D126-V128 PolarHBondContact O-N 2.86Å
127	G	39.6	Very low	41.1	Very low	75 Å²	75	150.3 Å²	150.3	77%	0.773	79%	0.79	S	S	*	*			trans	-64.2	84.2	166.3	0	0	0	0	0	110.7	E125 E129	E125-G127 VanDerWaalsContact C-N 3.31Å; E125-G127 PolarHBondContact O-N 2.91Å; G127-E129 VanDerWaalsContact C-N 3.32Å; G127-E129 PolarHBondContact O-N 2.98Å; G127-E129 VanDerWaalsContact O-N 3.13Å
128	V	44.3	Very low	40.7	Very low	122 Å²	122	152.6 Å²	152.6	74%	0.739	79%	0.79	S	S	*	*			trans	-80.8	85.9	164.7	-79.2	0	0	0	0	109.1	D126 M130	D126-V128 VanDerWaalsContact C-N 3.27Å; D126-V128 PolarHBondContact O-N 2.86Å; V128-M130 PolarHBondContact O-N 2.74Å; V128-M130 VanDerWaalsContact O-N 3.1Å
129	E	40.8	Very low	40.6	Very low	167 Å²	167	151 Å²	151	78%	0.78	79%	0.789	S	S	*	*			trans	-61.8	102.2	165.7	-161.8	173.7	-162.1	0	0	108.1	G127 N131	G127-E129 VanDerWaalsContact C-N 3.32Å; G127-E129 PolarHBondContact O-N 2.98Å; G127-E129 VanDerWaalsContact O-N 3.13Å; E129-N131 PolarHBondContact O-N 3.45Å; E129-N131 PolarHBondContact O-OD1 3.4Å
130	M	43.2	Very low	39.7	Very low	173 Å²	173	147 Å²	147	85%	0.852	79%	0.786	S	S	*	*			trans	-73.8	95.7	176	-69.8	-71	-107.3	0	0	108.4	V128 D132	V128-M130 PolarHBondContact O-N 2.74Å; V128-M130 VanDerWaalsContact O-N 3.1Å; M130-D132 VanDerWaalsContact C-N 3.35Å; M130-D132 PolarHBondContact O-N 3.09Å
131	N	39.7	Very low	38.8	Very low	121 Å²	121	145.3 Å²	145.3	65%	0.647	79%	0.787	S	S	*	*			trans	-68.3	87.4	174.5	-55.4	-27.9	0	0	0	109.7	E129 N133	E129-N131 PolarHBondContact O-N 3.45Å; E129-N131 PolarHBondContact O-OD1 3.4Å; N131-N133 PolarHBondContact O-N 3.14Å
132	D	41.3	Very low	38.2	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	78%	0.784	S	S	*	*			trans	-78.8	72.9	172.5	-156.6	4.9	0	0	0	109.9	M130 G134	M130-D132 VanDerWaalsContact C-N 3.35Å; M130-D132 PolarHBondContact O-N 3.09Å; D132-G134 VanDerWaalsContact C-N 3.31Å; D132-G134 PolarHBondContact O-N 3.06Å
133	N	35.3	Very low	37.1	Very low	155 Å²	155	142.2 Å²	142.2	83%	0.829	78%	0.783	S	S	*	*			trans	-90.6	66.9	172.8	-77	50.5	0	0	0	109.7	N131	N131-N133 PolarHBondContact O-N 3.14Å
134	G	34.5	Very low	36.8	Very low	64 Å²	64	138 Å²	138	66%	0.66	77%	0.771	S	S	*	*			trans	-113.8	64.1	173.4	0	0	0	0	0	112.1	D132 E136	D132-G134 VanDerWaalsContact C-N 3.31Å; D132-G134 PolarHBondContact O-N 3.06Å; G134-E136 PolarHBondContact O-N 3.26Å
135	N	29.9	Very low	36.3	Very low	136 Å²	136	140.5 Å²	140.5	73%	0.727	77%	0.773	S	S	*	*			trans	-73.8	103.9	173.3	179.4	44.5	0	0	0	110.4
136	E	33.9	Very low	35.4	Very low	190 Å²	190	139 Å²	139	89%	0.888	77%	0.772	S	S	*	*			trans	-144.4	80.3	159.7	-136.7	176.4	-164	0	0	112.3	G134 R138	G134-E136 PolarHBondContact O-N 3.26Å; E136-R138 PolarHBondContact O-N 3.43Å
137	I	33.4	Very low	34.6	Very low	124 Å²	124	137 Å²	137	64%	0.636	77%	0.768	S	S	*	*			trans	-14.4	112.2	146.6	-51.8	162.8	0	0	0	113.5
138	R	33.9	Very low	34	Very low	242 Å²	242	143.5 Å²	143.5	91%	0.913	78%	0.775	S	S	*	*			trans	-128	93.9	149.8	-92.1	-172	170.9	179.7	-1	110.1	E136	E136-R138 PolarHBondContact O-N 3.43Å
139	D	31.9	Very low	33.2	Very low	137 Å²	137	144.6 Å²	144.6	73%	0.733	78%	0.777	S	S	*	*			trans	23.7	97.8	141.4	-67.9	-35.3	0	0	0	118.7	S141	D139-S141 PolarHBondContact O-N 2.88Å
140	A	27.3	Very low	32.6	Very low	92 Å²	92	142.6 Å²	142.6	76%	0.76	78%	0.776	S	S	*	*				33	72.6	106.1	0	0	0	0	0	117.5	T142	A140-T142 VanDerWaalsContact C-N 3.29Å; A140-T142 PolarHBondContact O-N 3.46Å; A140-T142 VanDerWaalsContact O-N 3.16Å
141	S	33.7	Very low	31.8	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	78%	0.777	S	S	*	*			trans	-75.8	92	144.9	63	0	0	0	0	108.8	D139	D139-S141 PolarHBondContact O-N 2.88Å
142	T	31.7	Very low	31.3	Very low	131 Å²	131	145 Å²	145	80%	0.804	78%	0.784	S	S	*	*			trans	-7.5	116.8	148.3	28.8	0	0	0	0	117.4	A140	A140-T142 VanDerWaalsContact C-N 3.29Å; A140-T142 PolarHBondContact O-N 3.46Å; A140-T142 VanDerWaalsContact O-N 3.16Å
143	L	27.7	Very low	30.6	Very low	159 Å²	159	143.1 Å²	143.1	83%	0.832	78%	0.782	S	S	*	*			trans	-24.7	162.7	142.3	-131.7	65.3	0	0	0	114.1
144	P	36	Very low	30.4	Very low	88 Å²	88	141 Å²	141	57%	0.571	78%	0.779	S	S	*	*			cis	-152.5	177	19.1	42.7	-20.7	0	0	0	119.5
145	Q	31.5	Very low	30	Very low	157 Å²	157	144.3 Å²	144.3	73%	0.734	79%	0.786	S	S	*	*			trans	68.8	85	143.2	-75.6	156.1	12.2	0	0	118.4
146	N	30.2	Very low	29.8	Very low	164 Å²	164	145.6 Å²	145.6	88%	0.877	79%	0.792	S	S	*	*			trans	-99.1	101.4	140.1	-110.2	-6	0	0	0	108.3	F148	N146-F148 PolarHBondContact O-N 3.21Å; N146-F148 VanDerWaalsContact O-N 3.09Å
147	C	27.4	Very low	29.7	Very low	106 Å²	106	141.8 Å²	141.8	72%	0.716	78%	0.783	S	S	*	*			trans	-63.3	102.6	-179.8	-65	0	0	0	0	110.7	N149	C147-N149 PolarHBondContact O-N 2.88Å
148	F	27.3	Very low	29.4	Very low	211 Å²	211	142.3 Å²	142.3	93%	0.925	79%	0.792	S	S	*	*			trans	-70.7	100.8	152.8	-80.7	-86.8	0	0	0	107.7	N146	N146-F148 PolarHBondContact O-N 3.21Å; N146-F148 VanDerWaalsContact O-N 3.09Å
149	N	26.9	Very low	29.1	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	78%	0.783	S	S	*	*			trans	-148.6	151.8	164.2	-144.2	-21.2	0	0	0	109.6	C147	C147-N149 PolarHBondContact O-N 2.88Å
150	V	28.2	Very low	29	Very low	125 Å²	125	135.4 Å²	135.4	76%	0.758	78%	0.783	S	S	*	*			trans	94.8	117.6	171.5	-165	0	0	0	0	115.8
151	R	27.2	Very low	28.8	Very low	231 Å²	231	139.4 Å²	139.4	87%	0.872	79%	0.789	S	S	*	*			trans	91.9	83	164	-81.1	169.2	174.9	172.1	-1.1	118.8
152	S	29.1	Very low	28.8	Very low	114 Å²	114	139.4 Å²	139.4	80%	0.797	79%	0.785	S	S	*	*				-170.6	96.1	124.4	-76.7	0	0	0	0	107
153	C	26.6	Very low	28.5	Very low	118 Å²	118	137.7 Å²	137.7	80%	0.797	78%	0.779	S	S	*	*				88	114.8	96.1	-72.3	0	0	0	0	114.1
154	S	29.7	Very low	28.7	Very low	110 Å²	110	138 Å²	138	77%	0.769	78%	0.781	S	S	*	*			trans	56.7	116.5	156.1	55.8	0	0	0	0	117.8
155	V	26	Very low	28.2	Very low	134 Å²	134	137 Å²	137	81%	0.812	79%	0.787	S	S	*	*			cis	55.3	91.3	26.3	-167.9	0	0	0	0	114
156	I	27.2	Very low	28	Very low	163 Å²	163	138.2 Å²	138.2	84%	0.836	79%	0.792	S	S	*	*				175.2	149.9	118.2	-85.6	167.7	0	0	0	109.4
157	P	31.8	Very low	28	Very low	109 Å²	109	137.1 Å²	137.1	71%	0.708	79%	0.787	S	S	*	*			trans	-110.5	170.2	-141.7	38.9	-29.1	0	0	0	116.9
158	V	25.4	Very low	28.1	Very low	136 Å²	136	139.7 Å²	139.7	82%	0.824	79%	0.792	S	S	*	*			trans	-16.8	133.9	164	-172.9	0	0	0	0	117.5
159	P	27.8	Very low	28.1	Very low	112 Å²	112	134 Å²	134	73%	0.727	78%	0.777	S	S	*	*			trans	-125.3	127.6	142.1	21.8	-2.4	0	0	0	113.5
160	V	29.7	Very low	28.2	Very low	121 Å²	121	134.1 Å²	134.1	73%	0.733	77%	0.773	S	S	*	*			trans	74.9	105.6	132	-172.8	0	0	0	0	118.6
161	M	24.3	Very low	28.2	Very low	177 Å²	177	137.6 Å²	137.6	87%	0.872	78%	0.778	S	S	*	*			trans	-66.7	143.9	148	-69.4	-160.4	102.5	0	0	110.6
162	P	33.4	Very low	28.3	Very low	116 Å²	116	133.5 Å²	133.5	75%	0.753	77%	0.769	S	S	*	*			trans	-123	128.4	130.4	21.9	-5.7	0	0	0	110.9
163	S	25.5	Very low	28.3	Very low	95 Å²	95	133.9 Å²	133.9	66%	0.664	77%	0.768	S	S	*	*			trans	-56.5	143.3	161.8	51.1	0	0	0	0	112.8
164	N	32.3	Very low	28.4	Very low	166 Å²	166	133.2 Å²	133.2	89%	0.888	77%	0.765	S	S	*	*			trans	-167.4	111.3	135.8	-84.1	-23.8	0	0	0	105.6
165	G	25.8	Very low	28.4	Very low	66 Å²	66	134.5 Å²	134.5	68%	0.68	77%	0.768	S	S	*	*				79.3	96.3	108	0	0	0	0	0	110.1
166	E	26.8	Very low	28.5	Very low	183 Å²	183	134.2 Å²	134.2	86%	0.855	76%	0.763	S	S	*	*				52.5	99	107.2	-70.7	-178.5	159.2	0	0	110.2
167	D	30.2	Very low	28.5	Very low	142 Å²	142	131.7 Å²	131.7	76%	0.759	76%	0.759	S	S	*	*				-155.7	128.9	86.2	-83.2	-38.2	0	0	0	113	C169	D167-C169 VanDerWaalsContact C-N 3.3Å; D167-C169 PolarHBondContact O-N 3.44Å; D167-C169 VanDerWaalsContact O-N 3.08Å
168	I	29.7	Very low	28.3	Very low	159 Å²	159	134.5 Å²	134.5	82%	0.815	76%	0.763	S	S	*	*			trans	-77.2	83.2	166.2	-55.8	167.4	0	0	0	106.4	Q170	I168-Q170 HydrophobicContact CG2-CG 4.3Å; I168-Q170 PolarHBondContact O-N 3.39Å; I168-Q170 VanDerWaalsContact O-N 3.09Å
169	C	27.4	Very low	28.4	Very low	93 Å²	93	132.8 Å²	132.8	63%	0.628	76%	0.757	S	S	*	*			trans	-79.4	92.1	167.5	-68.8	0	0	0	0	109.2	D167 F171	D167-C169 VanDerWaalsContact C-N 3.3Å; D167-C169 PolarHBondContact O-N 3.44Å; D167-C169 VanDerWaalsContact O-N 3.08Å; C169-F171 PolarHBondContact O-N 2.94Å
170	Q	28.9	Very low	28.4	Very low	147 Å²	147	137.4 Å²	137.4	69%	0.687	77%	0.766	S	S	*	*			trans	-53.8	105	160.2	-68.6	174.8	-11.6	0	0	108.8	I168 H172	I168-Q170 HydrophobicContact CG2-CG 4.3Å; I168-Q170 PolarHBondContact O-N 3.39Å; I168-Q170 VanDerWaalsContact O-N 3.09Å; Q170-H172 PolarHBondContact O-N 2.89Å
171	F	27	Very low	28.5	Very low	198 Å²	198	137.8 Å²	137.8	87%	0.868	77%	0.768	S	S	*	*			trans	-73.3	98.8	165.9	-91.3	-87.4	0	0	0	108.2	C169	C169-F171 PolarHBondContact O-N 2.94Å
172	H	30	Very low	28.7	Very low	145 Å²	145	137.6 Å²	137.6	67%	0.671	77%	0.765	S	S	*	*			trans	-59.1	137.2	162.3	-77.7	-90.3	0	0	0	109.5	Q170 S174	Q170-H172 PolarHBondContact O-N 2.89Å; H172-S174 PolarHBondContact O-N 3.25Å
173	P	29.1	Very low	28.6	Very low	121 Å²	121	137.7 Å²	137.7	79%	0.786	77%	0.766	S	S	*	*			trans	-64.9	102.8	170.5	25.9	-30.7	0	0	0	108.5	T175	P173-T175 PolarHBondContact O-N 3.03Å; P173-T175 VanDerWaalsContact O-N 3.17Å
174	S	28.3	Very low	28.9	Very low	104 Å²	104	141 Å²	141	73%	0.727	78%	0.775	S	S	*	*			trans	-72.1	107.9	170	42.2	0	0	0	0	108.6	H172 N176	H172-S174 PolarHBondContact O-N 3.25Å; S174-N176 PolarHBondContact O-N 3.19Å
175	T	30.4	Very low	28.8	Very low	137 Å²	137	140.9 Å²	140.9	84%	0.84	78%	0.775	S	S	*	*			trans	-53.9	87.5	157.9	44.8	0	0	0	0	109.1	P173	P173-T175 PolarHBondContact O-N 3.03Å; P173-T175 VanDerWaalsContact O-N 3.17Å
176	N	27.2	Very low	28.9	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	77%	0.769	S	S	*	*			trans	-100.3	83.3	166.8	-141.3	-18.6	0	0	0	107.4	S174 Q178	S174-N176 PolarHBondContact O-N 3.19Å; N176-Q178 PolarHBondContact O-N 2.99Å
177	S	27.9	Very low	29	Very low	110 Å²	110	142.8 Å²	142.8	77%	0.769	77%	0.77	S	S	*	*			trans	-62	83.8	160.3	49.9	0	0	0	0	107.9	S179	S177-S179 VanDerWaalsContact C-N 3.31Å; S177-S179 PolarHBondContact O-N 3.48Å
178	Q	27	Very low	29	Very low	168 Å²	168	145.6 Å²	145.6	79%	0.785	78%	0.776	S	S	*	*			trans	-68.1	99.3	161.1	-89.3	-179.6	-10.2	0	0	106.9	N176 F180	N176-Q178 PolarHBondContact O-N 2.99Å; Q178-F180 PolarHBondContact O-N 3.4Å
179	S	28.7	Very low	29.1	Very low	100 Å²	100	146.9 Å²	146.9	70%	0.699	78%	0.776	S	S	*	*			trans	-46.1	128.3	164.2	54.5	0	0	0	0	109.4	S177 V181	S177-S179 VanDerWaalsContact C-N 3.31Å; S177-S179 PolarHBondContact O-N 3.48Å; S179-V181 PolarHBondContact O-N 2.96Å
180	F	26.8	Very low	29.6	Very low	208 Å²	208	148 Å²	148	91%	0.912	78%	0.782	S	S	*	*			trans	-44.9	114	168.6	-86.1	-99.2	0	0	0	109.2	Q178 E182	Q178-F180 PolarHBondContact O-N 3.4Å; F180-E182 PolarHBondContact O-N 3.19Å
181	V	31.7	Very low	29.7	Very low	129 Å²	129	148.4 Å²	148.4	78%	0.782	79%	0.789	S	S	*	*			trans	-58.5	121	170.6	174.9	0	0	0	0	106.7	S179	S179-V181 PolarHBondContact O-N 2.96Å
182	E	28.4	Very low	29.8	Very low	173 Å²	173	146.6 Å²	146.6	81%	0.808	79%	0.788	S	S	*	*			trans	-45.4	138.7	172.7	-98.2	177.9	141.1	0	0	110.6	F180 L184	F180-E182 PolarHBondContact O-N 3.19Å; E182-L184 PolarHBondContact O-N 3.26Å
183	P	31.7	Very low	29.9	Very low	118 Å²	118	144.7 Å²	144.7	77%	0.766	79%	0.791	S	S	*	*			trans	-57	119.4	178.3	23	-30.9	0	0	0	108.8	N185	P183-N185 PolarHBondContact O-N 2.82Å
184	L	31.6	Very low	30.1	Very low	164 Å²	164	144.1 Å²	144.1	86%	0.859	79%	0.786	S	S	*	*			trans	-47	112.5	173.7	-73.3	162.7	0	0	0	108.8	E182 G186	E182-L184 PolarHBondContact O-N 3.26Å; L184-G186 PolarHBondContact O-N 2.92Å
185	N	30.5	Very low	30.4	Very low	165 Å²	165	146.6 Å²	146.6	88%	0.882	79%	0.791	S	S	*	*			trans	-63.7	66.9	163.8	-89.6	-46.7	0	0	0	109	P183 R187	P183-N185 PolarHBondContact O-N 2.82Å; N185-R187 VanDerWaalsContact C-N 3.34Å; N185-R187 PolarHBondContact O-N 3.04Å
186	G	27.2	Very low	30.3	Very low	54 Å²	54	149.1 Å²	149.1	56%	0.557	79%	0.79	S	S	*	*			trans	-73.4	89.6	173.5	0	0	0	0	0	108.6	L184 F188	L184-G186 PolarHBondContact O-N 2.92Å; G186-F188 VanDerWaalsContact C-N 3.33Å; G186-F188 PolarHBondContact O-N 3.34Å
187	R	29	Very low	30.7	Very low	234 Å²	234	149.4 Å²	149.4	88%	0.883	80%	0.796	S	S	*	*			trans	-57.9	96.2	166.5	-68.3	-175.8	178.3	-153.7	0.4	108.7	N185 K189	N185-R187 VanDerWaalsContact C-N 3.34Å; N185-R187 PolarHBondContact O-N 3.04Å; R187-K189 PolarHBondContact O-N 3.17Å
188	F	31.6	Very low	31	Very low	201 Å²	201	149.3 Å²	149.3	88%	0.882	80%	0.796	S	S	*	*			trans	-63.3	105.4	162.8	-83.6	-86	0	0	0	107.6	G186 P190	G186-F188 VanDerWaalsContact C-N 3.33Å; G186-F188 PolarHBondContact O-N 3.34Å; F188-P190 VanDerWaalsContact O-CD 3.26Å; F188-P190 WeakPolarHBondContact O-CD 3.31Å
189	K	31.8	Very low	31	Very low	187 Å²	187	145 Å²	145	81%	0.813	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70.4	116	165.6	-78.7	-175.7	175.3	179.5	0	107.5	R187 N191	R187-K189 PolarHBondContact O-N 3.17Å; K189-N191 PolarHBondContact O-N 3.31Å
190	P	36	Very low	31.1	Very low	115 Å²	115	149 Å²	149	75%	0.747	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.5	123.6	166.7	-8.5	25.8	0	0	0	107.2	F188 N192	F188-P190 VanDerWaalsContact O-CD 3.26Å; F188-P190 WeakPolarHBondContact O-CD 3.31Å; P190-N192 PolarHBondContact O-N 3.13Å
191	N	32.2	Very low	31.2	Very low	157 Å²	157	148.2 Å²	148.2	84%	0.84	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-60.5	126.4	170.9	-80.3	-30.3	0	0	0	109.1	K189 S193	K189-N191 PolarHBondContact O-N 3.31Å; N191-S193 PolarHBondContact O-N 3.02Å
192	N	29.5	Very low	31.2	Very low	160 Å²	160	151 Å²	151	86%	0.856	80%	0.799	S	S	*	*			trans	-59.5	99.4	172.6	-69.1	-40.4	0	0	0	110	P190	P190-N192 PolarHBondContact O-N 3.13Å
193	S	32.1	Very low	31.2	Very low	105 Å²	105	149 Å²	149	73%	0.734	80%	0.799	S	S	*	*			trans	-112.1	112.4	155.4	68.3	0	0	0	0	109	N191 D195	N191-S193 PolarHBondContact O-N 3.02Å; S193-D195 VanDerWaalsContact C-N 3.33Å; S193-D195 PolarHBondContact O-N 2.91Å
194	T	31.9	Very low	31	Very low	109 Å²	109	148.4 Å²	148.4	67%	0.669	80%	0.798	S	S	*	*			trans	-83.4	60.9	-162.2	-31.4	0	0	0	0	111.9	K196	T194-K196 VanDerWaalsContact C-N 3.3Å; T194-K196 HydrophobicContact CG2-CG 4.36Å; T194-K196 PolarHBondContact O-N 3.11Å; T194-K196 VanDerWaalsContact O-N 3.07Å
195	D	34.4	Very low	31.2	Very low	156 Å²	156	147.3 Å²	147.3	83%	0.834	79%	0.791	S	S	*	*			trans	-85.6	82.3	169.1	-78.9	-22.9	0	0	0	109.9	S193 V197	S193-D195 VanDerWaalsContact C-N 3.33Å; S193-D195 PolarHBondContact O-N 2.91Å; D195-V197 PolarHBondContact O-N 2.78Å; D195-V197 VanDerWaalsContact O-N 3.12Å
196	K	30.3	Very low	30.9	Very low	190 Å²	190	149.6 Å²	149.6	83%	0.826	79%	0.789	S	S	*	*			trans	-66.4	99.1	167.4	-74.3	-177.4	177	-179.7	0	109	T194	T194-K196 VanDerWaalsContact C-N 3.3Å; T194-K196 HydrophobicContact CG2-CG 4.36Å; T194-K196 PolarHBondContact O-N 3.11Å; T194-K196 VanDerWaalsContact O-N 3.07Å
197	V	34.3	Very low	31.2	Very low	135 Å²	135	155.5 Å²	155.5	82%	0.818	80%	0.802	S	S	*	*			trans	-119.1	129.6	156.7	-175.3	0	0	0	0	109.1	D195	D195-V197 PolarHBondContact O-N 2.78Å; D195-V197 VanDerWaalsContact O-N 3.12Å
198	S	34.5	Very low	31.1	Very low	108 Å²	108	151.2 Å²	151.2	76%	0.755	80%	0.796	S	S	*	*			trans	-53.6	126.8	-160.7	50.6	0	0	0	0	115.9	K200	S198-K200 PolarHBondContact O-N 2.76Å
199	G	26.8	Very low	31	Very low	78 Å²	78	144.8 Å²	144.8	80%	0.804	79%	0.786	S	S	*	*			trans	-65.3	122.4	167.2	0	0	0	0	0	112.3
200	K	31	Very low	30.7	Very low	184 Å²	184	146.3 Å²	146.3	80%	0.8	79%	0.789	S	S	*	*			trans	-96.8	102.3	155.3	-86	-179.5	175.1	177.1	0	107.9	S198 F202	S198-K200 PolarHBondContact O-N 2.76Å; K200-F202 HydrophobicContact CB-CE2 4.4Å; K200-F202 PolarHBondContact O-N 3.43Å
201	K	29.8	Very low	30.4	Very low	190 Å²	190	149.6 Å²	149.6	83%	0.826	79%	0.794	S	S	*	*			trans	-62.2	117.9	166.6	-74.6	175.2	173.7	178.3	0	108.6
202	F	30.2	Very low	30.2	Very low	188 Å²	188	150 Å²	150	83%	0.825	79%	0.791	S	S	*	*			trans	-116.5	90.2	156	-80.5	-78.7	0	0	0	107.9	K200	K200-F202 HydrophobicContact CB-CE2 4.4Å; K200-F202 PolarHBondContact O-N 3.43Å
203	T	28.7	Very low	30.1	Very low	130 Å²	130	148.6 Å²	148.6	80%	0.798	78%	0.784	S	S	*	*			trans	-76.7	107.8	157.6	40.5	0	0	0	0	107.1
204	S	28.6	Very low	30.1	Very low	106 Å²	106	152.1 Å²	152.1	74%	0.741	79%	0.788	S	S	*	*			trans	-118.9	106.3	165.9	179.5	0	0	0	0	107.3
205	I	34.5	Very low	29.7	Very low	142 Å²	142	153.3 Å²	153.3	73%	0.728	80%	0.799	S	S	*	*			trans	-67.9	126.3	176.2	-64.4	166.3	0	0	0	107.1	H207	I205-H207 PolarHBondContact O-N 3.47Å
206	Y	25.6	Very low	29.4	Very low	213 Å²	213	153.7 Å²	153.7	84%	0.835	80%	0.8	S	S	*	*			trans	-59.9	116	172.2	-87.6	-104.6	0	0	0	109
207	H	31.9	Very low	29.3	Very low	177 Å²	177	149.7 Å²	149.7	82%	0.819	80%	0.796	S	S	*	*			trans	-98.2	103.1	164.2	-97.4	-61.2	0	0	0	108.4	I205 G209	I205-H207 PolarHBondContact O-N 3.47Å; H207-G209 PolarHBondContact O-N 3.46Å
208	D	27.7	Very low	29	Very low	145 Å²	145	149.4 Å²	149.4	78%	0.775	80%	0.797	S	S	*	*			trans	-66.9	94.1	165	-80	-39.1	0	0	0	109.1
209	G	29.6	Very low	28.7	Very low	65 Å²	65	151.1 Å²	151.1	67%	0.67	80%	0.796	S	S	*	*			trans	-117.9	85	172.3	0	0	0	0	0	109.8	H207 Q211	H207-G209 PolarHBondContact O-N 3.46Å; G209-Q211 PolarHBondContact O-N 3.3Å
210	Y	25.2	Very low	28.6	Very low	219 Å²	219	151.9 Å²	151.9	86%	0.859	80%	0.795	S	S	*	*			trans	-59.9	102.3	165.6	-90.2	-101	0	0	0	109.4
211	Q	30.1	Very low	28.4	Very low	185 Å²	185	151.8 Å²	151.8	86%	0.864	80%	0.795	S	S	*	*			trans	-123.7	101.8	165.8	-79	-93.8	-44.5	0	0	107.5	G209	G209-Q211 PolarHBondContact O-N 3.3Å
212	Q	26.9	Very low	28.3	Very low	165 Å²	165	147.6 Å²	147.6	77%	0.771	79%	0.787	S	S	*	*			trans	-67.7	147.5	167.2	-82.8	174	-26.1	0	0	110.3
213	N	27.5	Very low	28.1	Very low	131 Å²	131	145.6 Å²	145.6	70%	0.701	79%	0.791	S	S	*	*			trans	77.6	100.4	161.9	-48.7	-38.2	0	0	0	115.8
214	H	32.2	Very low	28.2	Very low	178 Å²	178	148.7 Å²	148.7	82%	0.824	79%	0.793	S	S	*	*				-163.6	126	122.6	-81.9	-51.6	0	0	0	108.8	L216	H214-L216 PolarHBondContact O-N 3.23Å; H214-L216 VanDerWaalsContact O-N 3.12Å
215	C	23.5	Very low	28.1	Very low	134 Å²	134	146.7 Å²	146.7	91%	0.905	79%	0.789	S	S	*	*			trans	-60.8	109.4	168.8	-65.2	0	0	0	0	108.3
216	L	28	Very low	27.6	Very low	164 Å²	164	148.4 Å²	148.4	86%	0.859	79%	0.794	S	S	*	*			trans	-104.5	126.1	171.1	-75.6	170.7	0	0	0	109.4	H214	H214-L216 PolarHBondContact O-N 3.23Å; H214-L216 VanDerWaalsContact O-N 3.12Å
217	S	28.2	Very low	27.9	Very low	106 Å²	106	144 Å²	144	74%	0.741	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-60.2	160.5	-169.1	-50.7	0	0	0	0	114.7
218	P	29.3	Very low	27.8	Very low	129 Å²	129	146.3 Å²	146.3	84%	0.838	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.9	136.5	-175.6	-18.6	31.1	0	0	0	112.8	A220	P218-A220 PolarHBondContact O-N 2.99Å
219	I	27.3	Very low	27.9	Very low	144 Å²	144	146.7 Å²	146.7	74%	0.738	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-57.4	118.8	179.5	-64.7	163.5	0	0	0	110	F221	I219-F221 PolarHBondContact O-N 2.88Å
220	A	24.9	Very low	27.9	Very low	94 Å²	94	148.2 Å²	148.2	78%	0.777	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.1	119	173.5	0	0	0	0	0	110.1	P218	P218-A220 PolarHBondContact O-N 2.99Å
221	F	26.1	Very low	28.3	Very low	182 Å²	182	146.5 Å²	146.5	80%	0.798	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.7	137.2	171.5	-72.4	-85.5	0	0	0	110.4	I219	I219-F221 PolarHBondContact O-N 2.88Å
222	P	28.3	Very low	28.1	Very low	103 Å²	103	147.3 Å²	147.3	67%	0.669	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.4	130.8	-173	26.5	-32.6	0	0	0	112.4	F224	P222-F224 PolarHBondContact O-N 2.93Å; P222-F224 VanDerWaalsContact O-N 3.08Å
223	T	25.7	Very low	28.1	Very low	145 Å²	145	147.1 Å²	147.1	89%	0.89	80%	0.796	S	S	*	*			trans	-62	96.6	178.4	-31.4	0	0	0	0	111.1
224	F	30.5	Very low	28.1	Very low	195 Å²	195	149.3 Å²	149.3	86%	0.855	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.7	118.7	164.7	-92.9	-88.1	0	0	0	109.4	P222	P222-F224 PolarHBondContact O-N 2.93Å; P222-F224 VanDerWaalsContact O-N 3.08Å
225	G	26.7	Very low	28.1	Very low	64 Å²	64	145.7 Å²	145.7	66%	0.66	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-58.4	138.5	-176.2	0	0	0	0	0	112.9	P227	G225-P227 VanDerWaalsContact O-CD 3.3Å; G225-P227 WeakPolarHBondContact O-CD 3.42Å
226	H	24.6	Very low	28.3	Very low	179 Å²	179	149.8 Å²	149.8	83%	0.829	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-58.2	128.5	169	-77.1	15.3	0	0	0	112
227	P	31.8	Very low	28.3	Very low	121 Å²	121	150.5 Å²	150.5	79%	0.786	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-92	118	132.3	10.4	9.6	0	0	0	107.3	G225 N229	G225-P227 VanDerWaalsContact O-CD 3.3Å; G225-P227 WeakPolarHBondContact O-CD 3.42Å; P227-N229 PolarHBondContact O-N 3.22Å; P227-N229 VanDerWaalsContact O-N 3.12Å
228	R	28.8	Very low	28.2	Very low	224 Å²	224	150.6 Å²	150.6	85%	0.845	80%	0.796	S	S	*	*	S	Bend	trans	-53.7	115.1	165.5	-65.1	176.2	-177.5	175.8	-0.3	108
229	N	31.7	Very low	28.1	Very low	154 Å²	154	153.3 Å²	153.3	82%	0.824	80%	0.798	S	S	*	*			trans	179.1	70.4	148.4	-86.1	-13.2	0	0	0	106.9	P227 E231	P227-N229 PolarHBondContact O-N 3.22Å; P227-N229 VanDerWaalsContact O-N 3.12Å; N229-E231 PolarHBondContact O-N 3.45Å
230	S	29.2	Very low	28	Very low	97 Å²	97	150.9 Å²	150.9	68%	0.678	79%	0.794	S	S	*	*			trans	-76.2	81.7	167.6	59.5	0	0	0	0	108.3	Y232	S230-Y232 PolarHBondContact O-N 3.08Å
231	E	32	Very low	28.1	Very low	182 Å²	182	153.9 Å²	153.9	85%	0.85	80%	0.795	S	S	*	*			trans	-67.6	80.8	151.4	-75.4	177	175.2	0	0	106.4	N229 L233	N229-E231 PolarHBondContact O-N 3.45Å; E231-L233 VanDerWaalsContact C-N 3.29Å; E231-L233 PolarHBondContact O-N 3.42Å
232	Y	26.5	Very low	28.1	Very low	202 Å²	202	154.1 Å²	154.1	79%	0.792	79%	0.792	S	S	*	*			trans	-67.8	96.8	166.8	-96.6	-83.5	0	0	0	107.1	S230 Q234	S230-Y232 PolarHBondContact O-N 3.08Å; Y232-Q234 PolarHBondContact O-N 3.42Å
233	L	27.4	Very low	28	Very low	162 Å²	162	154.1 Å²	154.1	85%	0.848	79%	0.792	S	S	*	*			trans	-54.4	109.8	158.9	-75.4	167.8	0	0	0	107.4	E231 P235	E231-L233 VanDerWaalsContact C-N 3.29Å; E231-L233 PolarHBondContact O-N 3.42Å; L233-P235 WeakPolarHBondContact O-CD 3.48Å
234	Q	28.4	Very low	28	Very low	176 Å²	176	153.4 Å²	153.4	82%	0.822	79%	0.787	S	S	*	*			trans	-63.4	123.6	-176.3	-147.5	171.8	-8.9	0	0	108.9	Y232 F236	Y232-Q234 PolarHBondContact O-N 3.42Å; Q234-F236 PolarHBondContact O-N 3.4Å
235	P	31	Very low	27.8	Very low	103 Å²	103	154.2 Å²	154.2	67%	0.669	79%	0.786	S	S	*	*			trans	-61.7	129.2	175.3	-18.1	29.9	0	0	0	109.4	L233 Q237	L233-P235 WeakPolarHBondContact O-CD 3.48Å; P235-Q237 PolarHBondContact O-N 3.48Å
236	F	28.1	Very low	27.9	Very low	219 Å²	219	156.1 Å²	156.1	96%	0.961	79%	0.789	S	S	*	*			trans	-51.2	94.1	171.2	-81.6	-96.3	0	0	0	110.4	Q234	Q234-F236 PolarHBondContact O-N 3.4Å
237	Q	27.7	Very low	28	Very low	180 Å²	180	158.7 Å²	158.7	84%	0.841	79%	0.792	S	S	*	*			trans	-90.6	103.1	164.4	-67.3	-140.5	-27.5	0	0	107.3	P235 E239	P235-Q237 PolarHBondContact O-N 3.48Å; Q237-E239 PolarHBondContact O-N 3.11Å
238	S	26.9	Very low	27.9	Very low	108 Å²	108	159.8 Å²	159.8	76%	0.755	79%	0.791	S	S	*	*			trans	-40.5	120.8	166.4	45.4	0	0	0	0	110.8	S240	S238-S240 PolarHBondContact O-N 3.26Å
239	E	26	Very low	28.1	Very low	186 Å²	186	154.4 Å²	154.4	87%	0.869	79%	0.785	S	S	*	*			trans	-52.8	95.2	170.8	-74.6	170.2	140.5	0	0	109.9	Q237 I241	Q237-E239 PolarHBondContact O-N 3.11Å; E239-I241 PolarHBondContact O-N 3.18Å
240	S	26	Very low	28	Very low	93 Å²	93	152.2 Å²	152.2	65%	0.65	78%	0.781	S	S	*	*			trans	-87.3	100.6	157.9	56.2	0	0	0	0	105.9	S238 Y242	S238-S240 PolarHBondContact O-N 3.26Å; S240-Y242 PolarHBondContact O-N 2.96Å
241	I	27.6	Very low	27.9	Very low	156 Å²	156	155 Å²	155	80%	0.8	79%	0.788	S	S	*	*			trans	-67.9	80.5	173.8	-55.9	169	0	0	0	106.9	E239	E239-I241 PolarHBondContact O-N 3.18Å
242	Y	25.1	Very low	27.8	Very low	188 Å²	188	151.8 Å²	151.8	74%	0.737	78%	0.783	S	S	*	*			trans	-99.7	124.9	155.7	-81.1	-79.8	0	0	0	107	S240 T244	S240-Y242 PolarHBondContact O-N 2.96Å; Y242-T244 VanDerWaalsContact C-N 3.28Å; Y242-T244 PolarHBondContact O-N 3.18Å; Y242-T244 PolarHBondContact O-OG1 3.26Å
243	P	26	Very low	28	Very low	102 Å²	102	148 Å²	148	66%	0.662	78%	0.78	S	S	*	*			trans	-69.3	90.2	174.7	27	-30.9	0	0	0	108.7	Y245	P243-Y245 PolarHBondContact O-N 3.48Å; P243-Y245 VanDerWaalsContact O-N 3.17Å
244	T	25.5	Very low	28	Very low	130 Å²	130	145.3 Å²	145.3	80%	0.798	78%	0.775	S	S	*	*			trans	-75.9	100.7	169.9	-36.9	0	0	0	0	107.1	Y242 S246	Y242-T244 VanDerWaalsContact C-N 3.28Å; Y242-T244 PolarHBondContact O-N 3.18Å; Y242-T244 PolarHBondContact O-OG1 3.26Å; T244-S246 PolarHBondContact O-N 3.18Å
245	Y	27.7	Very low	28	Very low	213 Å²	213	144.2 Å²	144.2	84%	0.835	77%	0.773	S	S	*	*			trans	-59.5	104.7	167.7	-74.7	-87.4	0	0	0	108.6	P243 R247	P243-Y245 PolarHBondContact O-N 3.48Å; P243-Y245 VanDerWaalsContact O-N 3.17Å; Y245-R247 PolarHBondContact O-N 3.15Å; Y245-R247 VanDerWaalsContact O-N 3.11Å
246	S	27.6	Very low	27.8	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	78%	0.776	S	S	*	*			trans	-62.3	105.9	166	-179	0	0	0	0	108.6	T244	T244-S246 PolarHBondContact O-N 3.18Å
247	R	27.7	Very low	27.7	Very low	234 Å²	234	141 Å²	141	88%	0.883	77%	0.767	S	S	*	*			trans	-106.3	91.9	153.8	-94.3	-172.1	174.2	176.4	-0.8	105.9	Y245 P249	Y245-R247 PolarHBondContact O-N 3.15Å; Y245-R247 VanDerWaalsContact O-N 3.11Å; R247-P249 WeakPolarHBondContact O-CD 3.26Å
248	D	29.4	Very low	27.7	Very low	143 Å²	143	140.3 Å²	140.3	77%	0.765	77%	0.767	S	S	*	*			trans	-67.7	115.1	157	-109.5	-37.3	0	0	0	107.8
249	P	32.7	Very low	27.6	Very low	111 Å²	111	142.7 Å²	142.7	72%	0.721	77%	0.768	S	S	*	*			trans	-113	56.5	176.3	33.1	-13.3	0	0	0	108.6	R247	R247-P249 WeakPolarHBondContact O-CD 3.26Å
250	C	29.5	Very low	27.8	Very low	109 Å²	109	138.9 Å²	138.9	74%	0.736	76%	0.762	S	S	*	*			trans	-150.2	51.7	179.2	-80.1	0	0	0	0	111.5	P252	C250-P252 WeakPolarHBondContact O-CD 3.32Å
251	D	27.6	Very low	27.7	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	77%	0.768	S	S	*	*			trans	-95.7	103	155.4	-112.3	-23.4	0	0	0	107.8	V253	D251-V253 PolarHBondContact O-N 3.23Å
252	P	30.1	Very low	27.9	Very low	114 Å²	114	141.1 Å²	141.1	74%	0.74	77%	0.767	S	S	*	*			trans	-74.6	92.4	-178	30.6	-32.4	0	0	0	108.7	C250 S254	C250-P252 WeakPolarHBondContact O-CD 3.32Å; P252-S254 VanDerWaalsContact C-N 3.34Å; P252-S254 PolarHBondContact O-N 3.41Å
253	V	30.2	Very low	28	Very low	122 Å²	122	138 Å²	138	74%	0.739	77%	0.767	S	S	*	*			trans	-71	99.9	166.5	-177.9	0	0	0	0	107.7	D251 I255	D251-V253 PolarHBondContact O-N 3.23Å; V253-I255 HydrophobicContact CG1-CG1 4.33Å; V253-I255 PolarHBondContact O-N 3.27Å
254	S	27.5	Very low	27.9	Very low	105 Å²	105	139 Å²	139	73%	0.734	78%	0.777	S	S	*	*			trans	-55.1	95.6	170.3	45	0	0	0	0	111	P252	P252-S254 VanDerWaalsContact C-N 3.34Å; P252-S254 PolarHBondContact O-N 3.41Å
255	I	29.1	Very low	28.1	Very low	153 Å²	153	138.2 Å²	138.2	79%	0.785	78%	0.777	S	S	*	*			trans	-100.1	111	162.6	-57.6	-179.9	0	0	0	107.2	V253	V253-I255 HydrophobicContact CG1-CG1 4.33Å; V253-I255 PolarHBondContact O-N 3.27Å
256	N	25	Very low	27.9	Very low	136 Å²	136	133.5 Å²	133.5	73%	0.727	78%	0.775	S	S	*	*			trans	-51.7	141.8	-175.4	-79.1	-48.4	0	0	0	113	I258	N256-I258 PolarHBondContact O-N 3.29Å
257	P	26.2	Very low	28	Very low	118 Å²	118	137.6 Å²	137.6	77%	0.766	78%	0.782	S	S	*	*			trans	-74.5	112.8	-177.5	30.6	-32.4	0	0	0	110.1	M259	P257-M259 PolarHBondContact O-N 3.49Å
258	I	28.7	Very low	28	Very low	166 Å²	166	131.6 Å²	131.6	85%	0.851	78%	0.777	S	S	*	*			trans	-83	110.5	163.8	-62.8	178.7	0	0	0	107.1	N256 S260	N256-I258 PolarHBondContact O-N 3.29Å; I258-S260 PolarHBondContact O-N 3.36Å
259	M	25.2	Very low	28	Very low	159 Å²	159	130.9 Å²	130.9	78%	0.783	78%	0.779	S	S	*	*			trans	-51.7	123.6	169.8	-65.8	173.7	81	0	0	110.8	P257	P257-M259 PolarHBondContact O-N 3.49Å
260	S	29.2	Very low	27.9	Very low	105 Å²	105	133.3 Å²	133.3	73%	0.734	79%	0.785	S	S	*	*			trans	-148.5	99.6	148.5	54	0	0	0	0	109.3	I258 I262	I258-S260 PolarHBondContact O-N 3.36Å; S260-I262 PolarHBondContact O-N 2.79Å
261	N	25	Very low	27.7	Very low	145 Å²	145	136 Å²	136	78%	0.775	79%	0.787	S	S	*	*			trans	-56.9	111.2	169.1	-64.1	-46.4	0	0	0	110.4
262	I	30.6	Very low	27.8	Very low	152 Å²	152	134.1 Å²	134.1	78%	0.779	78%	0.781	S	S	*	*			trans	-139.2	97.7	155.3	-54.9	-179	0	0	0	109.6	S260	S260-I262 PolarHBondContact O-N 2.79Å
263	V	28.4	Very low	27.7	Very low	121 Å²	121	134.9 Å²	134.9	73%	0.733	78%	0.779	S	S	*	*			trans	43.2	107.5	137.1	-170.4	0	0	0	0	117.9	S265	V263-S265 PolarHBondContact O-N 3.12Å
264	S	23.3	Very low	27.5	Very low	124 Å²	124	140 Å²	140	87%	0.867	79%	0.787	S	S	*	*			trans	-39.4	114.2	155	-42.4	0	0	0	0	112.7
265	S	29.1	Very low	27.4	Very low	114 Å²	114	140.7 Å²	140.7	80%	0.797	79%	0.79	S	S	*	*			trans	-125	105.2	155.1	41	0	0	0	0	107.9	V263 E267	V263-S265 PolarHBondContact O-N 3.12Å; S265-E267 PolarHBondContact O-N 3.06Å
266	S	24.6	Very low	27.4	Very low	114 Å²	114	139 Å²	139	80%	0.797	79%	0.789	S	S	*	*			trans	-64.1	116	163.9	48.8	0	0	0	0	109.3
267	E	29.8	Very low	27.4	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	79%	0.785	S	S	*	*			trans	-164.9	107.9	146.9	-114.6	165	-176.5	0	0	111.1	S265	S265-E267 PolarHBondContact O-N 3.06Å
268	S	27.4	Very low	27.5	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	79%	0.788	S	S	*	*			trans	38.5	142.6	151.5	-62.8	0	0	0	0	123.3	L270	S268-L270 PolarHBondContact O-N 3.24Å
269	P	28.6	Very low	27.6	Very low	127 Å²	127	137.7 Å²	137.7	83%	0.825	79%	0.785	S	S	*	*			trans	-82.2	117.3	-167.9	1.5	19.8	0	0	0	110.5	H271	P269-H271 PolarHBondContact O-N 3.35Å
270	L	30.1	Very low	27.8	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	79%	0.79	S	S	*	*			trans	-73.6	107.8	164.2	-75.4	173.6	0	0	0	108.8	S268 V272	S268-L270 PolarHBondContact O-N 3.24Å; L270-V272 HydrophobicContact CB-CG2 4.4Å; L270-V272 PolarHBondContact O-N 3.35Å
271	H	25.2	Very low	27.7	Very low	165 Å²	165	142.2 Å²	142.2	76%	0.764	80%	0.798	S	S	*	*			trans	-62.3	92.5	165.8	-174	-74.3	0	0	0	108.7	P269 D273	P269-H271 PolarHBondContact O-N 3.35Å; H271-D273 IonicContact CE1-OD1 3.17Å; H271-D273 PolarHBondContact CE1-OD1 3.03Å; H271-D273 IonicContact ND1-OD1 2.92Å; H271-D273 PolarHBondContact ND1-OD1 3.27Å
272	V	31.4	Very low	27.9	Very low	118 Å²	118	143.3 Å²	143.3	72%	0.715	80%	0.803	S	S	*	*			trans	-95.9	113	172.7	-177.5	0	0	0	0	107.8	L270 Y274	L270-V272 HydrophobicContact CB-CG2 4.4Å; L270-V272 PolarHBondContact O-N 3.35Å; V272-Y274 PolarHBondContact O-N 2.89Å
273	D	28	Very low	27.7	Very low	130 Å²	130	143.5 Å²	143.5	70%	0.695	81%	0.806	S	S	*	*			trans	-56.2	120.5	179.1	-71.5	-48.4	0	0	0	111.5	H271 C275	H271-D273 IonicContact CE1-OD1 3.17Å; H271-D273 PolarHBondContact CE1-OD1 3.03Å; H271-D273 IonicContact ND1-OD1 2.92Å; H271-D273 PolarHBondContact ND1-OD1 3.27Å; D273-C275 PolarHBondContact O-N 3.07Å; D273-C275 VanDerWaalsContact O-N 3.17Å
274	Y	25.7	Very low	27.7	Very low	229 Å²	229	146.2 Å²	146.2	90%	0.898	81%	0.814	S	S	*	*			trans	-65.2	105.3	171.2	-99.1	-104.7	0	0	0	109.7	V272	V272-Y274 PolarHBondContact O-N 2.89Å
275	C	24.9	Very low	27.9	Very low	119 Å²	119	144.6 Å²	144.6	80%	0.804	81%	0.808	S	S	*	*			trans	-98.9	115	159.8	-161.9	0	0	0	0	108.6	D273 S277	D273-C275 PolarHBondContact O-N 3.07Å; D273-C275 VanDerWaalsContact O-N 3.17Å; C275-S277 PolarHBondContact O-N 3.32Å
276	P	28.1	Very low	27.9	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	81%	0.807	S	S	*	*			trans	-74.6	102	-174	29.2	-31.4	0	0	0	110	S278	P276-S278 PolarHBondContact O-N 2.64Å
277	S	27	Very low	28	Very low	92 Å²	92	150.6 Å²	150.6	64%	0.643	81%	0.811	S	S	*	*			trans	-66.2	109.3	173.2	168.9	0	0	0	0	110.6	C275 K279	C275-S277 PolarHBondContact O-N 3.32Å; S277-K279 PolarHBondContact O-N 3.47Å; S277-K279 VanDerWaalsContact O-N 3.09Å
278	S	27.2	Very low	27.9	Very low	119 Å²	119	150.2 Å²	150.2	83%	0.832	81%	0.814	S	S	*	*			trans	-64.6	98.4	165.2	65.5	0	0	0	0	110.6	P276	P276-S278 PolarHBondContact O-N 2.64Å
279	K	31.2	Very low	27.9	Very low	182 Å²	182	156.1 Å²	156.1	79%	0.791	82%	0.819	S	S	*	*			trans	-144.7	61.1	172.7	-78.5	-171.6	179.5	175.5	0	112.1	S277	S277-K279 PolarHBondContact O-N 3.47Å; S277-K279 VanDerWaalsContact O-N 3.09Å
280	Q	28	Very low	28.1	Very low	189 Å²	189	157.4 Å²	157.4	88%	0.883	82%	0.819	S	S	*	*			trans	-147.7	74	164.2	-72	-169.1	-8.8	0	0	110.3
281	N	27.6	Very low	28.1	Very low	170 Å²	170	158 Å²	158	91%	0.909	82%	0.817	S	S	*	*			trans	-164.9	71.4	157.1	-105.4	-29.1	0	0	0	109
282	L	28.9	Very low	28.2	Very low	168 Å²	168	153.9 Å²	153.9	88%	0.88	82%	0.819	S	S	*	*			trans	-150.5	69.8	177	-125.4	151.1	0	0	0	107.1
283	N	28.1	Very low	28.1	Very low	156 Å²	156	154.5 Å²	154.5	83%	0.834	82%	0.824	S	S	*	*			trans	-162.3	50.6	174.5	-103.3	-13.7	0	0	0	112.8
284	I	27.8	Very low	28.3	Very low	178 Å²	178	156 Å²	156	91%	0.913	83%	0.83	S	S	*	*			trans	-145.1	70.5	159.1	-48.3	176.1	0	0	0	108.6
285	A	28	Very low	28.3	Very low	90 Å²	90	150.6 Å²	150.6	74%	0.744	82%	0.823	S	S	*	*			trans	-158.3	60.2	168.4	0	0	0	0	0	110
286	H	28	Very low	28.5	Very low	168 Å²	168	152.2 Å²	152.2	78%	0.778	82%	0.824	S	S	*	*			trans	-139.2	44.6	-178.2	-104.2	-71.4	0	0	0	112.7
287	H	26.4	Very low	28.5	Very low	187 Å²	187	153.8 Å²	153.8	87%	0.866	83%	0.825	S	S	*	*	S	Bend	trans	-149.7	51.6	169.7	-79.7	-59	0	0	0	113.5
288	L	27.7	Very low	28.8	Very low	180 Å²	180	158.2 Å²	158.2	94%	0.942	84%	0.835	S	S	*	*			trans	-153.5	73.3	159.5	-76.2	-178.1	0	0	0	108.8
289	R	28.6	Very low	28.8	Very low	233 Å²	233	155.9 Å²	155.9	88%	0.879	83%	0.83	S	S	*	*			trans	-150.7	58.3	174	-148.1	-174.8	-166.9	-162.4	3.8	112.5
290	D	32.6	Very low	28.6	Very low	154 Å²	154	156.4 Å²	156.4	82%	0.824	83%	0.832	S	S	*	*			trans	-112.6	91.4	157.4	-73.1	-40.2	0	0	0	106.8
291	Q	29.9	Very low	28.4	Very low	174 Å²	174	153.2 Å²	153.2	81%	0.813	83%	0.828	S	S	*	*				72.2	74.4	95.5	-71.3	-160.6	61.2	0	0	112.6
292	G	28	Very low	28.5	Very low	78 Å²	78	152.6 Å²	152.6	80%	0.804	82%	0.823	S	S	*	*			trans	-109.1	102.8	156.4	0	0	0	0	0	108.7
293	T	27.6	Very low	28.5	Very low	132 Å²	132	151.8 Å²	151.8	81%	0.81	82%	0.82	S	S	*	*			trans	-69.3	123.8	177.5	3.2	0	0	0	0	110.8
294	I	32.1	Very low	28.5	Very low	162 Å²	162	149.1 Å²	149.1	83%	0.831	81%	0.813	S	S	*	*			trans	-133.8	115.2	156.9	-55.8	-179.5	0	0	0	107.8
295	P	26.6	Very low	28.5	Very low	114 Å²	114	148 Å²	148	74%	0.74	81%	0.809	S	S	*	*			trans	-91.6	130	174.7	33.3	-25.6	0	0	0	109.7
296	D	29.9	Very low	28.5	Very low	153 Å²	153	148.9 Å²	148.9	82%	0.818	81%	0.805	S	S	*	*			trans	-150.9	147.1	147.9	-146.8	-5.5	0	0	0	112.3
297	L	27.9	Very low	28.4	Very low	151 Å²	151	145.8 Å²	145.8	79%	0.791	80%	0.802	S	S	*	*			trans	-128.5	86.1	-146.5	-174.8	100.5	0	0	0	107.8
298	H	33.4	Very low	28.3	Very low	184 Å²	184	147.5 Å²	147.5	85%	0.852	80%	0.803	S	S	*	*			trans	-144.6	110.8	167.2	-88.7	-72.4	0	0	0	111.3
299	G	26.5	Very low	28.2	Very low	70 Å²	70	143.9 Å²	143.9	72%	0.722	79%	0.792	S	S	*	*			trans	-71.2	132.8	-180	0	0	0	0	0	112.9
300	F	26.8	Very low	28.1	Very low	193 Å²	193	142.5 Å²	142.5	85%	0.846	79%	0.793	S	S	*	*			trans	-134.8	128.8	146.8	-87.4	-82.1	0	0	0	108.7	I302	F300-I302 PolarHBondContact O-N 3.14Å
301	P	25.1	Very low	27.7	Very low	122 Å²	122	140.7 Å²	140.7	79%	0.792	79%	0.792	S	S	*	*			trans	-80.8	116.6	-178.9	31.7	-29.5	0	0	0	108.8
302	I	28.7	Very low	27.6	Very low	158 Å²	158	139.7 Å²	139.7	81%	0.81	79%	0.792	S	S	*	*			trans	-106.5	116.3	169.1	-54	178.4	0	0	0	107	F300 S304	F300-I302 PolarHBondContact O-N 3.14Å; I302-S304 PolarHBondContact O-N 3.48Å
303	N	28.8	Very low	27.3	Very low	151 Å²	151	141 Å²	141	81%	0.807	79%	0.788	S	S	*	*			trans	-53.8	126.3	174.5	-69.5	-36.1	0	0	0	110	D305	N303-D305 PolarHBondContact O-N 3.12Å; N303-D305 VanDerWaalsContact O-N 3.08Å
304	S	27.2	Very low	27.2	Very low	99 Å²	99	142.7 Å²	142.7	69%	0.692	79%	0.792	S	S	*	*			trans	-78	83.2	-178.1	54.1	0	0	0	0	111	I302 V306	I302-S304 PolarHBondContact O-N 3.48Å; S304-V306 VanDerWaalsContact C-N 3.35Å; S304-V306 PolarHBondContact O-N 3Å
305	D	28.6	Very low	26.8	Very low	156 Å²	156	143.2 Å²	143.2	83%	0.834	79%	0.793	S	S	*	*			trans	-82.1	92	155.5	-82.2	-28.8	0	0	0	108	N303 S307	N303-D305 PolarHBondContact O-N 3.12Å; N303-D305 VanDerWaalsContact O-N 3.08Å; D305-S307 PolarHBondContact O-N 3.15Å
306	V	28.4	Very low	26.8	Very low	107 Å²	107	143 Å²	143	65%	0.648	79%	0.789	S	S	*	*			trans	-69.9	76.6	179.7	-176.3	0	0	0	0	109	S304 Y308	S304-V306 VanDerWaalsContact C-N 3.35Å; S304-V306 PolarHBondContact O-N 3Å; V306-Y308 HydrophobicContact CG1-CD2 3.82Å; V306-Y308 HydrophobicContact CG1-CE2 3.72Å
307	S	26.3	Very low	26.6	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	78%	0.782	S	S	*	*			trans	-100.5	97.9	163.4	-72.9	0	0	0	0	108.5	D305 S309	D305-S307 PolarHBondContact O-N 3.15Å; S307-S309 VanDerWaalsContact C-N 3.31Å; S307-S309 PolarHBondContact O-N 2.89Å
308	Y	24.5	Very low	26.6	Very low	222 Å²	222	139 Å²	139	87%	0.871	78%	0.776	S	S	*	*			trans	-52.4	88.1	172.3	-88.8	-96.9	0	0	0	111.3	V306	V306-Y308 HydrophobicContact CG1-CD2 3.82Å; V306-Y308 HydrophobicContact CG1-CE2 3.72Å
309	S	25.7	Very low	26.2	Very low	104 Å²	104	137.3 Å²	137.3	73%	0.727	77%	0.773	S	S	*	*			trans	-106.3	110.7	166.3	-57.5	0	0	0	0	107.5	S307 S311	S307-S309 VanDerWaalsContact C-N 3.31Å; S307-S309 PolarHBondContact O-N 2.89Å; S309-S311 PolarHBondContact O-N 3.01Å
310	K	25.8	Very low	26.1	Very low	204 Å²	204	143.9 Å²	143.9	89%	0.887	78%	0.778	S	S	*	*			trans	-54.7	95.6	176.5	-72.6	170.5	175.2	173.8	0	110.1	L312	K310-L312 PolarHBondContact O-N 2.95Å
311	S	23.5	Very low	26.2	Very low	117 Å²	117	139.7 Å²	139.7	82%	0.818	77%	0.772	S	S	*	*			trans	-78.9	87.5	164.6	164.4	0	0	0	0	108.3	S309	S309-S311 PolarHBondContact O-N 3.01Å
312	L	27.4	Very low	26.3	Very low	152 Å²	152	141 Å²	141	80%	0.796	77%	0.773	S	S	*	*			trans	-85.7	117.6	164.3	-129.5	122.3	0	0	0	107.3	K310	K310-L312 PolarHBondContact O-N 2.95Å
313	C	23.3	Very low	26.3	Very low	107 Å²	107	138.8 Å²	138.8	72%	0.723	77%	0.768	S	S	*	*			trans	22.9	102.1	161.5	-63.7	0	0	0	0	117.8	M315	C313-M315 PolarHBondContact O-N 3.24Å
314	N	24	Very low	26.4	Very low	167 Å²	167	137.2 Å²	137.2	89%	0.893	77%	0.767	S	S	*	*			trans	-64.6	74.9	147.5	-82.3	-16.2	0	0	0	109.3	V316	N314-V316 PolarHBondContact O-N 2.79Å
315	M	25.3	Very low	26.5	Very low	172 Å²	172	138.4 Å²	138.4	85%	0.847	77%	0.765	S	S	*	*			trans	-78.7	100.1	151.9	-103.7	177.9	71.5	0	0	105.8	C313 S317	C313-M315 PolarHBondContact O-N 3.24Å; M315-S317 PolarHBondContact O-N 3.09Å; M315-S317 VanDerWaalsContact O-N 3.13Å
316	V	25.4	Very low	26.7	Very low	111 Å²	111	135.9 Å²	135.9	67%	0.673	76%	0.755	S	S	*	*			trans	2.3	99.7	158.1	-175	0	0	0	0	111.6	N314 N318	N314-V316 PolarHBondContact O-N 2.79Å; V316-N318 WeakPolarHBondContact CG1-OD1 3.43Å; V316-N318 PolarHBondContact O-N 3.11Å
317	S	26.6	Very low	26.9	Very low	94 Å²	94	134.1 Å²	134.1	66%	0.657	75%	0.748	S	S	*	*			trans	-60.2	84.3	157.7	58	0	0	0	0	106.4	M315 N319	M315-S317 PolarHBondContact O-N 3.09Å; M315-S317 VanDerWaalsContact O-N 3.13Å; S317-N319 PolarHBondContact O-N 3.4Å
318	N	26.5	Very low	27	Very low	125 Å²	125	135.5 Å²	135.5	67%	0.668	75%	0.747	S	S	*	*			trans	-58	104.7	154.4	-79.5	-29.7	0	0	0	103.6	V316 Y320	V316-N318 WeakPolarHBondContact CG1-OD1 3.43Å; V316-N318 PolarHBondContact O-N 3.11Å; N318-Y320 PolarHBondContact O-N 2.81Å
319	N	26.3	Very low	27	Very low	148 Å²	148	134.4 Å²	134.4	79%	0.791	74%	0.742	S	S	*	*			trans	-57.6	73.1	169.2	-64.5	-59	0	0	0	107.8	S317 S321	S317-N319 PolarHBondContact O-N 3.4Å; N319-S321 VanDerWaalsContact C-N 3.3Å; N319-S321 PolarHBondContact O-N 3.08Å
320	Y	24.7	Very low	27.4	Very low	209 Å²	209	135.1 Å²	135.1	82%	0.82	74%	0.741	S	S	*	*			trans	-70.9	106	147.8	-90.2	-85	0	0	0	103.9	N318 D322	N318-Y320 PolarHBondContact O-N 2.81Å; Y320-D322 PolarHBondContact O-N 3.29Å; Y320-D322 VanDerWaalsContact O-N 3.08Å
321	S	28.7	Very low	27.6	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	74%	0.736	S	S	*	*			trans	-45.7	120.2	164.5	-56.9	0	0	0	0	107	N319 P323	N319-S321 VanDerWaalsContact C-N 3.3Å; N319-S321 PolarHBondContact O-N 3.08Å; S321-P323 VanDerWaalsContact O-N 3.11Å
322	D	25.8	Very low	27.8	Very low	149 Å²	149	132.3 Å²	132.3	80%	0.797	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-46.6	125.7	164	-79.4	-42	0	0	0	106.5	Y320	Y320-D322 PolarHBondContact O-N 3.29Å; Y320-D322 VanDerWaalsContact O-N 3.08Å
323	P	30.2	Very low	27.9	Very low	111 Å²	111	130.2 Å²	130.2	72%	0.721	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-52.7	133	173.2	22.5	-31	0	0	0	106.7	S321 N325	S321-P323 VanDerWaalsContact O-N 3.11Å; P323-N325 PolarHBondContact O-N 3.47Å; P323-N325 VanDerWaalsContact O-N 3.15Å
324	P	29.2	Very low	28.2	Very low	119 Å²	119	132.1 Å²	132.1	77%	0.773	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-51.4	127.1	-165.8	16.7	-30.2	0	0	0	110.1	T326	P324-T326 PolarHBondContact O-N 2.95Å; P324-T326 VanDerWaalsContact O-N 3.14Å
325	N	29.4	Very low	28.4	Very low	123 Å²	123	128.8 Å²	128.8	66%	0.658	71%	0.708	S	S	*	*			trans	-20.8	114.8	167.6	-179.7	-4.2	0	0	0	110.7	P323 S327	P323-N325 PolarHBondContact O-N 3.47Å; P323-N325 VanDerWaalsContact O-N 3.15Å; N325-S327 PolarHBondContact O-N 2.84Å; N325-S327 PolarHBondContact O-OG 3.41Å; N325-S327 WeakPolarHBondContact OD1-CB 3.4Å; N325-S327 PolarHBondContact OD1-N 2.81Å; N325-S327 VanDerWaalsContact OD1-N 3.15Å
326	T	33	Very low	28.5	Very low	103 Å²	103	127.6 Å²	127.6	63%	0.632	71%	0.705	S	S	*	*	S	Bend	trans	-66.4	26.2	178.6	47.7	0	0	0	0	113.1	P324 N328 W329	P324-T326 PolarHBondContact O-N 2.95Å; P324-T326 VanDerWaalsContact O-N 3.14Å; T326-N328 PolarHBondContact O-N 3.45Å; T326-W329 VanDerWaalsContact O-CD1 3.3Å; T326-W329 PolarHBondContact O-N 2.86Å
327	S	32.5	Very low	28.4	Very low	71 Å²	71	129.5 Å²	129.5	50%	0.497	71%	0.706	S	S	.	*	G	3₁₀ helix	trans	-63.7	-5.6	172.1	56.5	0	0	0	0	113.7	N325	N325-S327 PolarHBondContact O-N 2.84Å; N325-S327 PolarHBondContact O-OG 3.41Å; N325-S327 WeakPolarHBondContact OD1-CB 3.4Å; N325-S327 PolarHBondContact OD1-N 2.81Å; N325-S327 VanDerWaalsContact OD1-N 3.15Å
328	N	28.6	Very low	28.3	Very low	132 Å²	132	130.5 Å²	130.5	71%	0.706	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-93.5	9.5	177.3	-69.9	-11.5	0	0	0	114.8	T326 V330 N331	T326-N328 PolarHBondContact O-N 3.45Å; N328-V330 PolarHBondContact O-N 3.27Å; N328-V330 VanDerWaalsContact O-N 3.14Å; N328-N331 PolarHBondContact O-N 3.39Å
329	W	25.7	Very low	28.3	Very low	200 Å²	200	130.1 Å²	130.1	76%	0.758	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-69	-2.1	169.4	-78.8	68	0	0	0	113.8	T326 N331	T326-W329 VanDerWaalsContact O-CD1 3.3Å; T326-W329 PolarHBondContact O-N 2.86Å; W329-N331 PolarHBondContact O-N 3.35Å
330	V	34	Very low	28.3	Very low	118 Å²	118	133.5 Å²	133.5	72%	0.715	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-74.2	-12.3	170.8	-173.1	0	0	0	0	112.3	N328	N328-V330 PolarHBondContact O-N 3.27Å; N328-V330 VanDerWaalsContact O-N 3.14Å
331	N	30.5	Very low	28.3	Very low	146 Å²	146	132.6 Å²	132.6	78%	0.781	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-109.3	11.2	-173.3	-116.3	-1.4	0	0	0	116.6	N328 W329	N328-N331 PolarHBondContact O-N 3.39Å; W329-N331 PolarHBondContact O-N 3.35Å
332	L	26.3	Very low	28.3	Very low	117 Å²	117	134.8 Å²	134.8	61%	0.613	72%	0.72	S	S	*	*			trans	-107.7	19.9	173.1	-79.4	166.4	0	0	0	113.8	N334 V335	L332-N334 PolarHBondContact O-N 3.3Å; L332-V335 HydrophobicContact CD2-CG2 4.19Å; L332-V335 PolarHBondContact O-N 3.28Å
333	T	29.1	Very low	28.1	Very low	108 Å²	108	131.1 Å²	131.1	66%	0.663	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-1.2	170.5	39.7	0	0	0	0	114.4
334	N	29.6	Very low	27.9	Very low	146 Å²	146	133.6 Å²	133.6	78%	0.781	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	4.2	177.5	-73.6	-13.9	0	0	0	115.1	L332 L336	L332-N334 PolarHBondContact O-N 3.3Å; N334-L336 PolarHBondContact O-N 3.22Å
335	V	29.3	Very low	27.7	Very low	97 Å²	97	132.6 Å²	132.6	59%	0.588	72%	0.72	S	S	*	*			trans	-85.3	70.5	164.9	-169.8	0	0	0	0	108.2	L332 H337	L332-V335 HydrophobicContact CD2-CG2 4.19Å; L332-V335 PolarHBondContact O-N 3.28Å; V335-H337 PolarHBondContact O-N 3.43Å
336	L	27	Very low	27.6	Very low	148 Å²	148	132.4 Å²	132.4	78%	0.775	73%	0.726	S	S	*	*			trans	-62.4	98.1	167	-83.1	157	0	0	0	107.8	N334	N334-L336 PolarHBondContact O-N 3.22Å
337	H	23.5	Very low	27.3	Very low	150 Å²	150	135.7 Å²	135.7	69%	0.694	73%	0.734	S	S	*	*			trans	-56.9	130.4	158.5	-79.6	-79.9	0	0	0	107.9	V335 T339	V335-H337 PolarHBondContact O-N 3.43Å; H337-T339 VanDerWaalsContact C-N 3.33Å; H337-T339 PolarHBondContact O-N 3.05Å; H337-T339 PolarHBondContact O-OG1 3.02Å
338	P	25.1	Very low	27	Very low	115 Å²	115	137.8 Å²	137.8	75%	0.747	75%	0.748	S	S	*	*			trans	-62.7	98.2	177.8	23.5	-30.4	0	0	0	108.3	Y340	P338-Y340 PolarHBondContact O-N 3.46Å
339	T	26.4	Very low	26.8	Very low	117 Å²	117	141.9 Å²	141.9	72%	0.718	75%	0.754	S	S	*	*			trans	-70.5	112.5	171.3	-52.7	0	0	0	0	105.2	H337 H341	H337-T339 VanDerWaalsContact C-N 3.33Å; H337-T339 PolarHBondContact O-N 3.05Å; H337-T339 PolarHBondContact O-OG1 3.02Å; T339-H341 PolarHBondContact O-N 3.4Å
340	Y	24.9	Very low	26.9	Very low	219 Å²	219	141.1 Å²	141.1	86%	0.859	76%	0.758	S	S	*	*			trans	-41.5	109.4	177.9	-64.4	-90.1	0	0	0	110.7	P338 I342	P338-Y340 PolarHBondContact O-N 3.46Å; Y340-I342 PolarHBondContact O-N 3.33Å
341	H	25.9	Very low	26.4	Very low	190 Å²	190	139 Å²	139	88%	0.88	76%	0.761	S	S	*	*			trans	-64.9	97.1	170	-77.2	-86.1	0	0	0	108.1	T339 G343	T339-H341 PolarHBondContact O-N 3.4Å; H341-G343 PolarHBondContact O-N 3.03Å
342	I	28.5	Very low	26.1	Very low	151 Å²	151	137 Å²	137	77%	0.774	76%	0.758	S	S	*	*			trans	-67.5	112.5	153.6	-67.5	165	0	0	0	104.9	Y340 L344	Y340-I342 PolarHBondContact O-N 3.33Å; I342-L344 PolarHBondContact O-N 3.49Å
343	G	21.7	Very low	26.3	Very low	73 Å²	73	141.6 Å²	141.6	75%	0.753	77%	0.768	S	S	*	*			trans	-59.1	95.7	-174.6	0	0	0	0	0	112.1	H341 S345	H341-G343 PolarHBondContact O-N 3.03Å; G343-S345 PolarHBondContact O-N 3.2Å
344	L	26.5	Very low	26.2	Very low	163 Å²	163	144 Å²	144	85%	0.853	78%	0.777	S	S	*	*			trans	-84.2	101.4	158.1	-65.8	176.3	0	0	0	106.6	I342	I342-L344 PolarHBondContact O-N 3.49Å
345	S	24.1	Very low	26.1	Very low	98 Å²	98	145.7 Å²	145.7	69%	0.685	78%	0.781	S	S	*	*			trans	-51.1	144.5	176	-173.3	0	0	0	0	111.4	G343 H347	G343-S345 PolarHBondContact O-N 3.2Å; S345-H347 PolarHBondContact O-N 3.26Å
346	P	27.5	Very low	26.1	Very low	118 Å²	118	146.3 Å²	146.3	77%	0.766	79%	0.787	S	S	*	*	S	Bend	trans	-76.5	33.5	-163.2	-13.1	30.8	0	0	0	116
347	H	26.5	Very low	26.2	Very low	173 Å²	173	148 Å²	148	80%	0.801	80%	0.796	S	S	*	*			trans	-122.8	65.6	-173	-71.1	-3.8	0	0	0	112.6	S345	S345-H347 PolarHBondContact O-N 3.26Å
348	S	26.7	Very low	26.3	Very low	115 Å²	115	146.8 Å²	146.8	80%	0.804	80%	0.798	S	S	*	*			trans	-149.7	94.3	148.4	-162.8	0	0	0	0	109.4
349	R	24.3	Very low	26.2	Very low	218 Å²	218	145.4 Å²	145.4	82%	0.823	79%	0.79	S	S	*	*			trans	-70.5	149.8	166	-64.6	-179.5	-179.8	-146.3	-0.1	107.7
350	H	26.5	Very low	26.4	Very low	184 Å²	184	148.1 Å²	148.1	85%	0.852	80%	0.8	S	S	*	*			trans	90	119	168.9	-54.1	-78.3	0	0	0	116.5
351	G	25.4	Very low	26.6	Very low	74 Å²	74	145.4 Å²	145.4	76%	0.763	80%	0.795	S	S	*	*			trans	141.7	65.6	162.5	0	0	0	0	0	114.3	Y353	G351-Y353 PolarHBondContact O-N 3.23Å
352	S	23.8	Very low	26.8	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	78%	0.781	S	S	*	*			trans	-56	114.5	157.7	149.9	0	0	0	0	108.4
353	Y	30	Very low	26.9	Very low	213 Å²	213	143 Å²	143	84%	0.835	79%	0.785	S	S	*	*			trans	-164.3	132.9	138.4	-84	-62.6	0	0	0	110.2	G351 Q355	G351-Y353 PolarHBondContact O-N 3.23Å; Y353-Q355 PolarHBondContact O-N 3.23Å
354	N	26.6	Very low	27.2	Very low	159 Å²	159	146.5 Å²	146.5	85%	0.85	78%	0.781	S	S	*	*			trans	-51.4	110.5	176.6	-59.6	-48.6	0	0	0	112
355	Q	28	Very low	27.4	Very low	182 Å²	182	144.3 Å²	144.3	85%	0.85	78%	0.777	S	S	*	*			trans	-123.3	112.3	160.2	-82.9	-178.4	0.3	0	0	109	Y353	Y353-Q355 PolarHBondContact O-N 3.23Å
356	P	29.1	Very low	27.7	Very low	110 Å²	110	144.9 Å²	144.9	71%	0.714	78%	0.78	S	S	*	*			trans	-61.8	136.8	171.9	-17.1	29.3	0	0	0	110.2	T358	P356-T358 PolarHBondContact O-N 2.98Å
357	L	28.5	Very low	27.6	Very low	184 Å²	184	146 Å²	146	96%	0.963	79%	0.786	S	S	*	*			trans	-53.9	98.2	174.3	-65	154.1	0	0	0	110
358	T	26.2	Very low	27.7	Very low	123 Å²	123	143.7 Å²	143.7	76%	0.755	78%	0.784	S	S	*	*			trans	-88.1	131.7	174.7	47	0	0	0	0	110.3	P356 L360	P356-T358 PolarHBondContact O-N 2.98Å; T358-L360 PolarHBondContact O-N 3.15Å
359	C	23.9	Very low	27.8	Very low	86 Å²	86	143.9 Å²	143.9	58%	0.581	79%	0.785	S	S	*	*			trans	-63.5	128.8	173.3	176.8	0	0	0	0	109.8	H361 H362	C359-H361 PolarHBondContact O-N 3.48Å; C359-H362 PolarHBondContact O-N 3.1Å
360	L	30.4	Very low	28	Very low	175 Å²	175	136.2 Å²	136.2	92%	0.916	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-2.9	-176.9	-112	129.8	0	0	0	115.6	T358	T358-L360 PolarHBondContact O-N 3.15Å
361	H	29	Very low	28	Very low	161 Å²	161	135.8 Å²	135.8	75%	0.745	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	-0.8	-177	-84.8	-92.5	0	0	0	115.4	C359	C359-H361 PolarHBondContact O-N 3.48Å
362	H	30.8	Very low	28.1	Very low	128 Å²	128	137.8 Å²	137.8	59%	0.593	78%	0.776	S	S	*	*			trans	-128.7	94	178.4	-61.9	-54.3	0	0	0	111	C359 H364	C359-H362 PolarHBondContact O-N 3.1Å; H362-H364 VanDerWaalsContact C-N 3.28Å; H362-H364 PolarHBondContact O-N 2.93Å
363	L	29.2	Very low	28.2	Very low	164 Å²	164	137.5 Å²	137.5	86%	0.859	78%	0.779	S	S	*	*			trans	-69.1	88.2	167	-165.9	73.1	0	0	0	108.1	P365	L363-P365 WeakPolarHBondContact O-CD 3.37Å
364	H	28.3	Very low	28.1	Very low	146 Å²	146	132.6 Å²	132.6	68%	0.676	77%	0.774	S	S	*	*			trans	-75.1	120.7	169.5	-80.7	-86.7	0	0	0	108.6	H362 S366	H362-H364 VanDerWaalsContact C-N 3.28Å; H362-H364 PolarHBondContact O-N 2.93Å; H364-S366 PolarHBondContact O-N 2.72Å
365	P	30.9	Very low	28.2	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	77%	0.774	S	S	*	*			trans	-62.6	105.9	170.6	-13	26.9	0	0	0	107.4	L363 T367	L363-P365 WeakPolarHBondContact O-CD 3.37Å; P365-T367 PolarHBondContact O-N 3.17Å; P365-T367 VanDerWaalsContact O-N 3.07Å
366	S	30.4	Very low	28.3	Very low	109 Å²	109	129 Å²	129	76%	0.762	77%	0.769	S	S	*	*			trans	-67.6	110.5	175.2	-66.7	0	0	0	0	107.3	H364 T368	H364-S366 PolarHBondContact O-N 2.72Å; S366-T368 VanDerWaalsContact C-N 3.26Å; S366-T368 PolarHBondContact O-N 3.4Å
367	T	26.1	Very low	28.4	Very low	143 Å²	143	128 Å²	128	88%	0.877	77%	0.765	S	S	*	*			trans	-66.3	85.4	174.9	51.7	0	0	0	0	108.7	P365	P365-T367 PolarHBondContact O-N 3.17Å; P365-T367 VanDerWaalsContact O-N 3.07Å
368	T	28.6	Very low	28.7	Very low	123 Å²	123	122.9 Å²	122.9	76%	0.755	75%	0.75	S	S	*	*			trans	-111.6	113	162.2	-59.1	0	0	0	0	107.3	S366 G370	S366-T368 VanDerWaalsContact C-N 3.26Å; S366-T368 PolarHBondContact O-N 3.4Å; T368-G370 PolarHBondContact O-N 2.89Å
369	S	28.3	Very low	29.2	Very low	119 Å²	119	122.2 Å²	122.2	83%	0.832	74%	0.741	S	S	*	*			trans	-42.3	120.4	170.2	52.3	0	0	0	0	111.9
370	G	28.3	Very low	29.8	Very low	57 Å²	57	125 Å²	125	59%	0.588	75%	0.75	S	S	*	*			trans	-175.7	103.3	172.9	0	0	0	0	0	108.8	T368 T372	T368-G370 PolarHBondContact O-N 2.89Å; G370-T372 PolarHBondContact O-N 2.95Å
371	N	26.3	Very low	30.1	Very low	175 Å²	175	123.7 Å²	123.7	94%	0.936	74%	0.74	S	S	*	*			trans	-68.9	66	-170.9	-66.3	-35	0	0	0	113.8
372	T	27.8	Very low	30.6	Very low	117 Å²	117	122 Å²	122	72%	0.718	74%	0.735	S	S	*	*	S	Bend	trans	-137.4	108.7	164.6	39.2	0	0	0	0	106.5	G370 P374	G370-T372 PolarHBondContact O-N 2.95Å; T372-P374 WeakPolarHBondContact O-CD 3.33Å
373	A	24.9	Very low	31.3	Very low	97 Å²	97	120.4 Å²	120.4	80%	0.802	73%	0.734	S	S	*	*			trans	-42.8	110.2	170.8	0	0	0	0	0	108	T375	A373-T375 PolarHBondContact O-N 3.42Å
374	P	28.2	Very low	32.2	Very low	110 Å²	110	117.2 Å²	117.2	71%	0.714	73%	0.726	S	S	*	*			trans	-65.4	110.4	175.2	-11.7	26.2	0	0	0	104.5	T372 V376	T372-P374 WeakPolarHBondContact O-CD 3.33Å; P374-V376 PolarHBondContact O-N 3.36Å
375	T	28.5	Very low	33	Very low	139 Å²	139	115.9 Å²	115.9	85%	0.853	72%	0.724	S	S	*	*			trans	-53.7	97.1	152.6	18.4	0	0	0	0	104.6	A373 S377	A373-T375 PolarHBondContact O-N 3.42Å; T375-S377 PolarHBondContact O-N 2.79Å
376	V	30.1	Very low	33.9	Very low	125 Å²	125	113.6 Å²	113.6	76%	0.758	71%	0.708	S	S	*	*			trans	-62.9	89.9	174.7	177.2	0	0	0	0	104.9	P374 A378	P374-V376 PolarHBondContact O-N 3.36Å; V376-A378 PolarHBondContact O-N 3.26Å
377	S	32.5	Very low	35	Very low	89 Å²	89	112.4 Å²	112.4	62%	0.622	70%	0.695	S	S	*	*			trans	-64.5	94.9	163.5	-176	0	0	0	0	104.7	T375 N379	T375-S377 PolarHBondContact O-N 2.79Å; S377-N379 PolarHBondContact O-N 3.47Å
378	A	35	Very low	36.1	Very low	78 Å²	78	108.3 Å²	108.3	65%	0.645	68%	0.676	S	S	*	*			trans	-68	21	-179.5	0	0	0	0	0	112.7	V376 N380	V376-A378 PolarHBondContact O-N 3.26Å; A378-N380 VanDerWaalsContact C-N 3.3Å; A378-N380 PolarHBondContact O-N 2.84Å; A378-N380 VanDerWaalsContact O-N 3.16Å
379	N	35.2	Very low	37.1	Very low	108 Å²	108	108.3 Å²	108.3	58%	0.578	67%	0.67	S	S	*	*			trans	-93.4	64.5	-176.8	-69.2	-1.1	0	0	0	109.1	S377 H381	S377-N379 PolarHBondContact O-N 3.47Å; N379-H381 PolarHBondContact O-N 3.41Å
380	N	37	Very low	38	Very low	144 Å²	144	104.9 Å²	104.9	77%	0.77	65%	0.649	S	S	*	*			trans	-72.2	46.3	164	-72.3	-33.2	0	0	0	110.7	A378 L382	A378-N380 VanDerWaalsContact C-N 3.3Å; A378-N380 PolarHBondContact O-N 2.84Å; A378-N380 VanDerWaalsContact O-N 3.16Å; N380-L382 PolarHBondContact O-N 2.89Å; N380-L382 VanDerWaalsContact O-N 3.1Å
381	H	37.2	Very low	39	Very low	149 Å²	149	105.2 Å²	105.2	69%	0.69	65%	0.647	S	S	*	*			trans	-75.9	100.1	172.1	-64.1	-61.1	0	0	0	107.3	N379 T383	N379-H381 PolarHBondContact O-N 3.41Å; H381-T383 PolarHBondContact O-N 3.38Å; H381-T383 VanDerWaalsContact O-N 3.12Å
382	L	38.9	Very low	40.1	Very low	126 Å²	126	101 Å²	101	66%	0.66	64%	0.636	S	S	*	*			trans	-53.9	119.1	158.2	-66.5	172.2	0	0	0	106.3	N380 V386 V387	N380-L382 PolarHBondContact O-N 2.89Å; N380-L382 VanDerWaalsContact O-N 3.1Å; L382-V386 HydrophobicContact CD2-CG1 4.49Å; L382-V387 HydrophobicContact CB-CG2 4.29Å
383	T	45.7	Very low	41	Very low	93 Å²	93	99.6 Å²	99.6	57%	0.571	63%	0.631	S	S	*	*			trans	-55.5	142	174.3	37.5	0	0	0	0	109.1	H381 D385 V386	H381-T383 PolarHBondContact O-N 3.38Å; H381-T383 VanDerWaalsContact O-N 3.12Å; T383-D385 PolarHBondContact O-N 3.37Å; T383-V386 PolarHBondContact O-N 3.5Å
384	S	48.3	Very low	41.9	Very low	97 Å²	97	100.1 Å²	100.1	68%	0.678	62%	0.62	S	S	*	*	H	α-helix	trans	-44.3	-36.2	-176.6	-167.3	0	0	0	0	113.1	V386 V387 A388	S384-V386 PolarHBondContact O-N 3.3Å; S384-V387 PolarHBondContact O-N 3.01Å; S384-A388 PolarHBondContact O-N 3.01Å
385	D	45.2	Very low	42.7	Very low	118 Å²	118	99.7 Å²	99.7	63%	0.631	62%	0.617	S	S	*	*	H	α-helix	trans	-60.9	-38.1	179.4	-61.9	-14.4	0	0	0	113.6	T383 A388 I389	T383-D385 PolarHBondContact O-N 3.37Å; D385-A388 PolarHBondContact O-N 3.11Å; D385-I389 WeakPolarHBondContact O-CD1 3.5Å; D385-I389 VanDerWaalsContact O-CG1 3.23Å; D385-I389 WeakPolarHBondContact O-CG1 3.49Å; D385-I389 PolarHBondContact O-N 2.89Å
386	V	50.3	Low	43.5	Very low	70 Å²	70	98.9 Å²	98.9	42%	0.424	61%	0.614	S	S	.	*	H	α-helix	trans	-70.3	-36.8	179.9	-176.9	0	0	0	0	110.6	L382 T383 S384 I389 A390	L382-V386 HydrophobicContact CD2-CG1 4.49Å; T383-V386 PolarHBondContact O-N 3.5Å; S384-V386 PolarHBondContact O-N 3.3Å; V386-I389 PolarHBondContact O-N 3.12Å; V386-A390 VanDerWaalsContact O-CB 3.31Å; V386-A390 WeakPolarHBondContact O-CB 2.95Å; V386-A390 PolarHBondContact O-N 3.04Å
387	V	51.9	Low	44.1	Very low	83 Å²	83	100.2 Å²	100.2	50%	0.503	62%	0.616	S	S	.	*	H	α-helix	trans	-68	-40.5	176.4	-177.4	0	0	0	0	110.5	L382 S384 A390 A391	L382-V387 HydrophobicContact CB-CG2 4.29Å; S384-V387 PolarHBondContact O-N 3.01Å; V387-A390 PolarHBondContact O-N 3.35Å; V387-A391 WeakPolarHBondContact O-CB 3.47Å; V387-A391 PolarHBondContact O-N 2.96Å
388	A	50	Low	44.8	Very low	58 Å²	58	104.2 Å²	104.2	48%	0.479	63%	0.625	S	S	.	*	H	α-helix	trans	-63.3	-43.9	176.1	0	0	0	0	0	112.1	S384 D385 A391 A392	S384-A388 PolarHBondContact O-N 3.01Å; D385-A388 PolarHBondContact O-N 3.11Å; A388-A391 PolarHBondContact O-N 2.98Å; A388-A392 WeakPolarHBondContact O-CB 3.29Å; A388-A392 PolarHBondContact O-N 3.29Å
389	I	48.8	Very low	45.3	Very low	122 Å²	122	105.5 Å²	105.5	63%	0.626	63%	0.627	S	S	*	*	H	α-helix	trans	-65.7	-42.3	176.6	-64.9	163.9	0	0	0	110.7	D385 V386 A392 S393	D385-I389 WeakPolarHBondContact O-CD1 3.5Å; D385-I389 VanDerWaalsContact O-CG1 3.23Å; D385-I389 WeakPolarHBondContact O-CG1 3.49Å; D385-I389 PolarHBondContact O-N 2.89Å; V386-I389 PolarHBondContact O-N 3.12Å; I389-A392 PolarHBondContact O-N 3.03Å; I389-S393 WeakPolarHBondContact O-CB 3.4Å; I389-S393 PolarHBondContact O-N 3.13Å; I389-S393 PolarHBondContact O-OG 3.17Å
390	A	47.5	Very low	45.6	Very low	47 Å²	47	102.7 Å²	102.7	39%	0.388	62%	0.619	S	S	.	*	H	α-helix	trans	-62.5	-44.4	176.8	0	0	0	0	0	111.6	V386 V387 A392 S393 L394	V386-A390 VanDerWaalsContact O-CB 3.31Å; V386-A390 WeakPolarHBondContact O-CB 2.95Å; V386-A390 PolarHBondContact O-N 3.04Å; V387-A390 PolarHBondContact O-N 3.35Å; A390-A392 PolarHBondContact O-N 3.11Å; A390-S393 PolarHBondContact O-N 2.73Å; A390-S393 PolarHBondContact O-OG 2.88Å; A390-L394 WeakPolarHBondContact O-CG 3.33Å; A390-L394 PolarHBondContact O-N 2.68Å
391	A	49.1	Very low	46.1	Very low	65 Å²	65	99.5 Å²	99.5	54%	0.537	61%	0.608	S	S	.	*	H	α-helix	trans	-64.8	-38.2	177.1	0	0	0	0	0	112.5	V387 A388 S393 L394	V387-A391 WeakPolarHBondContact O-CB 3.47Å; V387-A391 PolarHBondContact O-N 2.96Å; A388-A391 PolarHBondContact O-N 2.98Å; A391-S393 VanDerWaalsContact C-N 3.32Å; A391-L394 PolarHBondContact O-N 3.09Å
392	A	49.5	Very low	46.4	Very low	87 Å²	87	102.8 Å²	102.8	72%	0.719	61%	0.614	S	S	*	*	H	α-helix	trans	-70	-28.6	175.8	0	0	0	0	0	113	A388 I389 A390 L394	A388-A392 WeakPolarHBondContact O-CB 3.29Å; A388-A392 PolarHBondContact O-N 3.29Å; I389-A392 PolarHBondContact O-N 3.03Å; A390-A392 PolarHBondContact O-N 3.11Å; A392-L394 VanDerWaalsContact C-N 3.35Å
393	S	48	Very low	46.8	Very low	87 Å²	87	104.4 Å²	104.4	61%	0.608	62%	0.616	S	S	*	*	H	α-helix	trans	-79.4	-15.2	178.8	74	0	0	0	0	114.2	I389 A390 A391	I389-S393 WeakPolarHBondContact O-CB 3.4Å; I389-S393 PolarHBondContact O-N 3.13Å; I389-S393 PolarHBondContact O-OG 3.17Å; A390-S393 PolarHBondContact O-N 2.73Å; A390-S393 PolarHBondContact O-OG 2.88Å; A391-S393 VanDerWaalsContact C-N 3.32Å
394	L	44.2	Very low	47	Very low	107 Å²	107	108 Å²	108	56%	0.56	62%	0.619	S	S	*	*	S	Bend	trans	-80.4	126.2	176.5	-71.8	167.8	0	0	0	109.4	A390 A391 A392	A390-L394 WeakPolarHBondContact O-CG 3.33Å; A390-L394 PolarHBondContact O-N 2.68Å; A391-L394 PolarHBondContact O-N 3.09Å; A392-L394 VanDerWaalsContact C-N 3.35Å
395	P	43.4	Very low	47.2	Very low	101 Å²	101	110.2 Å²	110.2	66%	0.656	62%	0.617	S	S	*	*			trans	-55.2	141.5	169.6	8.1	-8.8	0	0	0	108.4	L397	P395-L397 PolarHBondContact O-N 3.22Å
396	P	45.3	Very low	47.6	Very low	123 Å²	123	107.6 Å²	107.6	80%	0.799	61%	0.611	S	S	*	*			trans	-54.1	105.9	-177.1	19.6	-30.6	0	0	0	108.3	Q398	P396-Q398 VanDerWaalsContact C-N 3.34Å; P396-Q398 PolarHBondContact O-N 3.05Å
397	L	43.7	Very low	47.9	Very low	153 Å²	153	112.8 Å²	112.8	80%	0.801	62%	0.623	S	S	*	*			trans	-58.1	104	176.4	-74.6	165.2	0	0	0	105.3	P395	P395-L397 PolarHBondContact O-N 3.22Å
398	Q	47.7	Very low	48.2	Very low	172 Å²	172	112.9 Å²	112.9	80%	0.804	62%	0.62	S	S	*	*			trans	-51.7	131.5	176.1	-69.6	-154.1	-37.4	0	0	107	P396 A400	P396-Q398 VanDerWaalsContact C-N 3.34Å; P396-Q398 PolarHBondContact O-N 3.05Å; Q398-A400 PolarHBondContact O-N 2.96Å
399	P	43.9	Very low	48.5	Very low	106 Å²	106	115.8 Å²	115.8	69%	0.688	62%	0.624	S	S	*	*			trans	-52.8	118.5	-167.7	15.3	-28.2	0	0	0	108.7	S401	P399-S401 PolarHBondContact O-N 2.95Å
400	A	41.8	Very low	49.2	Very low	49 Å²	49	115.2 Å²	115.2	41%	0.405	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.4	-5.7	179	0	0	0	0	0	113.5	Q398 R402 F403 R404	Q398-A400 PolarHBondContact O-N 2.96Å; A400-R402 VanDerWaalsContact C-N 3.34Å; A400-R402 PolarHBondContact O-N 3.02Å; A400-F403 PolarHBondContact O-N 2.81Å; A400-R404 WeakPolarHBondContact O-CG 3.34Å; A400-R404 PolarHBondContact O-N 3.14Å
401	S	48.7	Very low	49.6	Very low	77 Å²	77	114.9 Å²	114.9	54%	0.538	61%	0.611	S	S	.	*	H	α-helix	trans	-39.5	-50.6	168.1	168.5	0	0	0	0	114.6	P399 F403 R404 K405	P399-S401 PolarHBondContact O-N 2.95Å; S401-F403 VanDerWaalsContact C-N 3.35Å; S401-F403 PolarHBondContact O-N 3.13Å; S401-R404 WeakPolarHBondContact O-CB 3.47Å; S401-R404 PolarHBondContact O-N 3.2Å; S401-K405 PolarHBondContact O-N 3.38Å
402	R	43.1	Very low	50	Low	218 Å²	218	113.4 Å²	113.4	82%	0.823	60%	0.595	S	S	*	*	H	α-helix	trans	-64.3	-40.2	-177.6	-84	-172.4	152.9	-149.9	-5.7	112.6	A400 A406	A400-R402 VanDerWaalsContact C-N 3.34Å; A400-R402 PolarHBondContact O-N 3.02Å; R402-A406 PolarHBondContact O-N 3.12Å
403	F	47.1	Very low	50.5	Low	159 Å²	159	114.6 Å²	114.6	70%	0.697	59%	0.586	S	S	*	*	H	α-helix	trans	-74	-29	176.5	-63.9	-73.5	0	0	0	112.3	A400 S401 R407	A400-F403 PolarHBondContact O-N 2.81Å; S401-F403 VanDerWaalsContact C-N 3.35Å; S401-F403 PolarHBondContact O-N 3.13Å; F403-R407 WeakPolarHBondContact O-CB 3.46Å; F403-R407 PolarHBondContact O-N 3Å
404	R	49.9	Very low	51	Low	168 Å²	168	113.3 Å²	113.3	63%	0.634	57%	0.57	S	S	*	*	H	α-helix	trans	-61.2	-46.4	174.7	-73.2	175	-165.6	-177.3	3.8	111.2	A400 S401 I408	A400-R404 WeakPolarHBondContact O-CG 3.34Å; A400-R404 PolarHBondContact O-N 3.14Å; S401-R404 WeakPolarHBondContact O-CB 3.47Å; S401-R404 PolarHBondContact O-N 3.2Å; R404-I408 WeakPolarHBondContact O-CB 3.45Å; R404-I408 VanDerWaalsContact O-CD1 3.28Å; R404-I408 WeakPolarHBondContact O-CD1 3.45Å; R404-I408 WeakPolarHBondContact O-CG1 3.48Å; R404-I408 PolarHBondContact O-N 2.8Å
405	K	51.7	Low	51.5	Low	145 Å²	145	109.8 Å²	109.8	63%	0.63	55%	0.55	S	S	*	.	H	α-helix	trans	-68.3	-43.9	-177.9	-165.5	173.3	-177.2	177.5	0	112.9	S401 I408 H409	S401-K405 PolarHBondContact O-N 3.38Å; K405-I408 PolarHBondContact O-N 2.84Å; K405-H409 PolarHBondContact O-CD2 3.19Å; K405-H409 VanDerWaalsContact O-CD2 3.23Å; K405-H409 PolarHBondContact O-N 2.98Å
406	A	53.9	Low	52	Low	62 Å²	62	107.6 Å²	107.6	51%	0.512	54%	0.537	S	S	.	.	H	α-helix	trans	-64.4	-44.2	177.3	0	0	0	0	0	111.8	R402 I408 H409 E410	R402-A406 PolarHBondContact O-N 3.12Å; A406-I408 PolarHBondContact O-N 3.41Å; A406-H409 PolarHBondContact O-N 3.5Å; A406-E410 WeakPolarHBondContact O-CB 3.49Å; A406-E410 PolarHBondContact O-N 2.89Å
407	R	57.3	Low	52.4	Low	179 Å²	179	110.1 Å²	110.1	68%	0.675	53%	0.532	S	S	*	.	H	α-helix	trans	-62.1	-41.7	175.3	-175.2	176	-75.2	-179.9	-4.6	111.4	F403 H409 E410 T411	F403-R407 WeakPolarHBondContact O-CB 3.46Å; F403-R407 PolarHBondContact O-N 3Å; R407-H409 PolarHBondContact O-N 3.39Å; R407-E410 PolarHBondContact O-N 2.95Å; R407-T411 VanDerWaalsContact O-CB 3.29Å; R407-T411 WeakPolarHBondContact O-CB 3.49Å; R407-T411 PolarHBondContact O-N 2.92Å; R407-T411 PolarHBondContact O-OG1 3.46Å
408	I	58.3	Low	52.6	Low	86 Å²	86	105.4 Å²	105.4	44%	0.441	52%	0.52	S	S	.	.	H	α-helix	trans	-61.8	-43.7	175.5	-68.6	160.8	0	0	0	110.9	R404 K405 A406 T411 V412	R404-I408 WeakPolarHBondContact O-CB 3.45Å; R404-I408 VanDerWaalsContact O-CD1 3.28Å; R404-I408 WeakPolarHBondContact O-CD1 3.45Å; R404-I408 WeakPolarHBondContact O-CG1 3.48Å; R404-I408 PolarHBondContact O-N 2.8Å; K405-I408 PolarHBondContact O-N 2.84Å; A406-I408 PolarHBondContact O-N 3.41Å; I408-T411 PolarHBondContact O-N 2.77Å; I408-V412 HydrophobicContact CG2-CG2 4.18Å; I408-V412 WeakPolarHBondContact O-CB 3.39Å; I408-V412 WeakPolarHBondContact O-CG2 3.48Å; I408-V412 PolarHBondContact O-N 3.46Å
409	H	55.8	Low	52.3	Low	119 Å²	119	106.3 Å²	106.3	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-63.1	-45.8	177.6	-82.1	-135	0	0	0	111.8	K405 A406 R407 V412 E413	K405-H409 PolarHBondContact O-CD2 3.19Å; K405-H409 VanDerWaalsContact O-CD2 3.23Å; K405-H409 PolarHBondContact O-N 2.98Å; A406-H409 PolarHBondContact O-N 3.5Å; R407-H409 PolarHBondContact O-N 3.39Å; H409-V412 PolarHBondContact O-N 3.45Å; H409-E413 WeakPolarHBondContact O-CB 3.33Å; H409-E413 PolarHBondContact O-N 2.86Å
410	E	63.8	Low	52.3	Low	109 Å²	109	108.4 Å²	108.4	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-62	-44.3	176.6	-177.8	-177.1	-173.8	0	0	111.6	A406 R407 E413 Q414	A406-E410 WeakPolarHBondContact O-CB 3.49Å; A406-E410 PolarHBondContact O-N 2.89Å; R407-E410 PolarHBondContact O-N 2.95Å; E410-E413 PolarHBondContact O-N 3.35Å; E410-Q414 WeakPolarHBondContact O-CB 3.47Å; E410-Q414 VanDerWaalsContact O-CG 3.28Å; E410-Q414 WeakPolarHBondContact O-CG 3.34Å; E410-Q414 PolarHBondContact O-N 2.92Å; E410-Q414 PolarHBondContact OE1-NE2 3.28Å
411	T	56.2	Low	52.3	Low	41 Å²	41	106.6 Å²	106.6	25%	0.252	50%	0.499	S	S	.	.	H	α-helix	trans	-62.5	-49.8	175.5	-57.3	0	0	0	0	110.1	R407 I408 E413 Q414 W415	R407-T411 VanDerWaalsContact O-CB 3.29Å; R407-T411 WeakPolarHBondContact O-CB 3.49Å; R407-T411 PolarHBondContact O-N 2.92Å; R407-T411 PolarHBondContact O-OG1 3.46Å; I408-T411 PolarHBondContact O-N 2.77Å; T411-E413 VanDerWaalsContact C-N 3.26Å; T411-E413 PolarHBondContact O-N 3.42Å; T411-Q414 PolarHBondContact O-N 2.85Å; T411-W415 HydrophobicContact CG2-CG 4.46Å; T411-W415 WeakPolarHBondContact O-CB 3.5Å; T411-W415 PolarHBondContact O-N 3.08Å
412	V	57.8	Low	52.3	Low	33 Å²	33	109 Å²	109	20%	0.2	51%	0.511	C	S	.	.	H	α-helix	trans	-58	-40.5	177.3	170.7	0	0	0	0	111.4	I408 H409 W415 S416 W433 V434	I408-V412 HydrophobicContact CG2-CG2 4.18Å; I408-V412 WeakPolarHBondContact O-CB 3.39Å; I408-V412 WeakPolarHBondContact O-CG2 3.48Å; I408-V412 PolarHBondContact O-N 3.46Å; H409-V412 PolarHBondContact O-N 3.45Å; V412-W415 PolarHBondContact O-N 3.02Å; V412-S416 WeakPolarHBondContact O-CB 3.43Å; V412-S416 PolarHBondContact O-N 3.08Å; V412-S416 PolarHBondContact O-OG 3.25Å; V412-W433 HydrophobicContact CG2-CH2 4.08Å; V412-W433 HydrophobicContact CG2-CZ3 4.16Å; V412-V434 HydrophobicContact CG1-CG1 4.42Å
413	E	59.9	Low	52.6	Low	113 Å²	113	106.6 Å²	106.6	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-66	-48.6	177.8	-167.8	172.9	-167.2	0	0	112	H409 E410 T411 W415 S416 Y417	H409-E413 WeakPolarHBondContact O-CB 3.33Å; H409-E413 PolarHBondContact O-N 2.86Å; E410-E413 PolarHBondContact O-N 3.35Å; T411-E413 VanDerWaalsContact C-N 3.26Å; T411-E413 PolarHBondContact O-N 3.42Å; E413-W415 VanDerWaalsContact C-N 3.27Å; E413-W415 PolarHBondContact O-N 3.19Å; E413-S416 WeakPolarHBondContact O-CB 3.44Å; E413-S416 PolarHBondContact O-N 2.92Å; E413-S416 VanDerWaalsContact O-N 3.14Å; E413-Y417 HydrophobicContact CG-CD2 3.91Å; E413-Y417 HydrophobicContact CG-CE2 3.64Å; E413-Y417 WeakPolarHBondContact O-CD2 3.45Å; E413-Y417 PolarHBondContact O-N 2.99Å; E413-Y417 VanDerWaalsContact O-N 3.16Å
414	Q	57.2	Low	52.7	Low	59 Å²	59	101 Å²	101	28%	0.276	49%	0.485	S	S	.	.	H	α-helix	trans	-56.5	-43.3	176.7	-73.9	178.2	9.6	0	0	111.6	E410 T411 Y417 G418 R419	E410-Q414 WeakPolarHBondContact O-CB 3.47Å; E410-Q414 VanDerWaalsContact O-CG 3.28Å; E410-Q414 WeakPolarHBondContact O-CG 3.34Å; E410-Q414 PolarHBondContact O-N 2.92Å; E410-Q414 PolarHBondContact OE1-NE2 3.28Å; T411-Q414 PolarHBondContact O-N 2.85Å; Q414-Y417 PolarHBondContact O-N 3.26Å; Q414-G418 PolarHBondContact O-N 3.12Å; Q414-R419 CarbonylContact C-O 3.49Å; Q414-R419 HydrophobicContact CB-CB 4.48Å; Q414-R419 WeakPolarHBondContact O-CA 3.46Å; Q414-R419 WeakPolarHBondContact O-CB 3.39Å; Q414-R419 PolarHBondContact O-N 2.78Å; Q414-R419 VanDerWaalsContact O-O 3.11Å
415	W	54.9	Low	52.3	Low	33 Å²	33	96.6 Å²	96.6	13%	0.125	48%	0.479	C	S	.	.	H	α-helix	trans	-69.3	-36	179.1	-74.5	60.1	0	0	0	112.8	T411 V412 E413 Y417 G418 D424 L427 I430 P431	T411-W415 HydrophobicContact CG2-CG 4.46Å; T411-W415 WeakPolarHBondContact O-CB 3.5Å; T411-W415 PolarHBondContact O-N 3.08Å; V412-W415 PolarHBondContact O-N 3.02Å; E413-W415 VanDerWaalsContact C-N 3.27Å; E413-W415 PolarHBondContact O-N 3.19Å; W415-Y417 VanDerWaalsContact C-N 3.29Å; W415-Y417 PolarHBondContact O-N 2.87Å; W415-G418 PolarHBondContact O-N 2.98Å; W415-G418 VanDerWaalsContact O-N 3.15Å; W415-D424 HydrophobicContact CH2-CB 4.29Å; W415-D424 HydrophobicContact CZ2-CB 3.51Å; W415-D424 PolarHBondContact NE1-OD2 2.88Å; W415-D424 VanDerWaalsContact NE1-OD2 3.15Å; W415-L427 HydrophobicContact CH2-CB 3.33Å; W415-L427 HydrophobicContact CH2-CD1 3.3Å; W415-L427 HydrophobicContact CH2-CG 3.83Å; W415-L427 HydrophobicContact CZ2-CB 4.25Å; W415-L427 HydrophobicContact CZ2-CD1 3.6Å; W415-L427 HydrophobicContact CZ2-CG 4.5Å; W415-L427 HydrophobicContact CZ3-CB 3.94Å; W415-I430 HydrophobicContact CE3-CG1 4.32Å; W415-P431 HydrophobicContact CH2-CG 4.26Å; W415-P431 HydrophobicContact CZ3-CG 4.3Å
416	S	53.7	Low	52.3	Low	55 Å²	55	97.6 Å²	97.6	39%	0.385	49%	0.486	S	S	.	.	H	α-helix	trans	-63.2	-35.4	176.5	-57.6	0	0	0	0	112.3	V412 E413 G418 Q438	V412-S416 WeakPolarHBondContact O-CB 3.43Å; V412-S416 PolarHBondContact O-N 3.08Å; V412-S416 PolarHBondContact O-OG 3.25Å; E413-S416 WeakPolarHBondContact O-CB 3.44Å; E413-S416 PolarHBondContact O-N 2.92Å; E413-S416 VanDerWaalsContact O-N 3.14Å; S416-G418 VanDerWaalsContact C-N 3.26Å; S416-G418 PolarHBondContact O-N 2.76Å; S416-Q438 PolarHBondContact OG-NE2 3.43Å
417	Y	54.1	Low	51.9	Low	177 Å²	177	98.5 Å²	98.5	69%	0.694	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	10.5	177.4	-70.4	-70.5	0	0	0	113.7	E413 Q414 W415 R419	E413-Y417 HydrophobicContact CG-CD2 3.91Å; E413-Y417 HydrophobicContact CG-CE2 3.64Å; E413-Y417 WeakPolarHBondContact O-CD2 3.45Å; E413-Y417 PolarHBondContact O-N 2.99Å; E413-Y417 VanDerWaalsContact O-N 3.16Å; Q414-Y417 PolarHBondContact O-N 3.26Å; W415-Y417 VanDerWaalsContact C-N 3.29Å; W415-Y417 PolarHBondContact O-N 2.87Å; Y417-R419 PolarHBondContact O-N 3.31Å; Y417-R419 VanDerWaalsContact O-N 3.12Å
418	G	47.8	Very low	51.6	Low	54 Å²	54	100 Å²	100	56%	0.557	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	16.6	-176.6	0	0	0	0	0	113.3	Q414 W415 S416 F420	Q414-G418 PolarHBondContact O-N 3.12Å; W415-G418 PolarHBondContact O-N 2.98Å; W415-G418 VanDerWaalsContact O-N 3.15Å; S416-G418 VanDerWaalsContact C-N 3.26Å; S416-G418 PolarHBondContact O-N 2.76Å; G418-F420 PolarHBondContact O-N 3.21Å
419	R	40.9	Very low	51.5	Low	190 Å²	190	99.3 Å²	99.3	72%	0.717	50%	0.501	S	S	*	.			trans	-79.7	104.2	171.9	-68	-153.2	176.8	177.5	2.2	107.4	Q414 Y417 S421	Q414-R419 CarbonylContact C-O 3.49Å; Q414-R419 HydrophobicContact CB-CB 4.48Å; Q414-R419 WeakPolarHBondContact O-CA 3.46Å; Q414-R419 WeakPolarHBondContact O-CB 3.39Å; Q414-R419 PolarHBondContact O-N 2.78Å; Q414-R419 VanDerWaalsContact O-O 3.11Å; Y417-R419 PolarHBondContact O-N 3.31Å; Y417-R419 VanDerWaalsContact O-N 3.12Å; R419-S421 PolarHBondContact O-N 2.7Å
420	F	44	Very low	51.5	Low	151 Å²	151	97.4 Å²	97.4	66%	0.662	49%	0.493	S	S	*	.			trans	-52.6	108	163.7	-64.9	-82	0	0	0	107.7	G418 V422	G418-F420 PolarHBondContact O-N 3.21Å; F420-V422 PolarHBondContact O-N 3.49Å
421	S	42.3	Very low	51.2	Low	11 Å²	11	94 Å²	94	8%	0.077	48%	0.481	C	S	.	.			trans	-51.3	131.5	163.2	148.4	0	0	0	0	106.3	R419 H423 D424 C425	R419-S421 PolarHBondContact O-N 2.7Å; S421-H423 PolarHBondContact O-N 3.17Å; S421-H423 PolarHBondContact OG-N 3.14Å; S421-D424 WeakPolarHBondContact CB-OD2 3.37Å; S421-D424 CarbonylContact O-C 3.59Å; S421-D424 PolarHBondContact O-N 3.4Å; S421-D424 PolarHBondContact OG-N 2.87Å; S421-D424 PolarHBondContact OG-OD2 3.38Å; S421-D424 VanDerWaalsContact OG-OD2 3.12Å; S421-C425 PolarHBondContact O-N 2.91Å
422	V	48.3	Very low	51.4	Low	128 Å²	128	98.3 Å²	98.3	78%	0.776	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.8	179.9	178	0	0	0	0	110.8	F420	F420-V422 PolarHBondContact O-N 3.49Å
423	H	49.1	Very low	52	Low	167 Å²	167	103.3 Å²	103.3	77%	0.773	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-17.4	176.9	-59	-61.3	0	0	0	114.2	S421	S421-H423 PolarHBondContact O-N 3.17Å; S421-H423 PolarHBondContact OG-N 3.14Å
424	D	50.2	Low	52.1	Low	41 Å²	41	98.1 Å²	98.1	22%	0.219	49%	0.494	C	S	.	.			trans	-112.7	16.7	-175.5	-65.8	-46.6	0	0	0	113.5	W415 S421 H426 L427	W415-D424 HydrophobicContact CH2-CB 4.29Å; W415-D424 HydrophobicContact CZ2-CB 3.51Å; W415-D424 PolarHBondContact NE1-OD2 2.88Å; W415-D424 VanDerWaalsContact NE1-OD2 3.15Å; S421-D424 WeakPolarHBondContact CB-OD2 3.37Å; S421-D424 CarbonylContact O-C 3.59Å; S421-D424 PolarHBondContact O-N 3.4Å; S421-D424 PolarHBondContact OG-N 2.87Å; S421-D424 PolarHBondContact OG-OD2 3.38Å; S421-D424 VanDerWaalsContact OG-OD2 3.12Å; D424-H426 PolarHBondContact O-N 3.29Å; D424-L427 HydrophobicContact CB-CD1 4.26Å; D424-L427 PolarHBondContact O-N 3.03Å
425	C	41.3	Very low	52.4	Low	75 Å²	75	97.2 Å²	97.2	51%	0.507	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-13.6	179.2	63.5	0	0	0	0	114.2	S421	S421-C425 PolarHBondContact O-N 2.91Å
426	H	50.5	Low	52.7	Low	167 Å²	167	100.5 Å²	100.5	77%	0.773	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-15.2	175.4	-62.8	-68.7	0	0	0	114.3	D424 K428	D424-H426 PolarHBondContact O-N 3.29Å; H426-K428 PolarHBondContact O-N 3.05Å; H426-K428 VanDerWaalsContact O-N 3.14Å
427	L	45.8	Very low	52.7	Low	81 Å²	81	102.1 Å²	102.1	42%	0.424	51%	0.514	S	S	.	.			trans	-87.6	89.4	179.7	-70	160.5	0	0	0	109	W415 D424 A429	W415-L427 HydrophobicContact CH2-CB 3.33Å; W415-L427 HydrophobicContact CH2-CD1 3.3Å; W415-L427 HydrophobicContact CH2-CG 3.83Å; W415-L427 HydrophobicContact CZ2-CB 4.25Å; W415-L427 HydrophobicContact CZ2-CD1 3.6Å; W415-L427 HydrophobicContact CZ2-CG 4.5Å; W415-L427 HydrophobicContact CZ3-CB 3.94Å; D424-L427 HydrophobicContact CB-CD1 4.26Å; D424-L427 PolarHBondContact O-N 3.03Å; L427-A429 PolarHBondContact O-N 3.23Å; L427-A429 VanDerWaalsContact O-N 3.09Å
428	K	52.1	Low	53	Low	210 Å²	210	97.8 Å²	97.8	91%	0.913	50%	0.5	S	S	*	.			trans	-60.2	-14.1	176	-74.9	-176.8	175.7	178	0	113.9	H426	H426-K428 PolarHBondContact O-N 3.05Å; H426-K428 VanDerWaalsContact O-N 3.14Å
429	A	55.7	Low	53.7	Low	72 Å²	72	102.5 Å²	102.5	60%	0.595	51%	0.506	S	S	*	.	S	Bend	trans	-137.4	142.6	-177.2	0	0	0	0	0	110.4	L427 P431	L427-A429 PolarHBondContact O-N 3.23Å; L427-A429 VanDerWaalsContact O-N 3.09Å; A429-P431 WeakPolarHBondContact O-CD 3.39Å
430	I	55.3	Low	54.4	Low	78 Å²	78	99.6 Å²	99.6	40%	0.4	50%	0.498	S	S	.	.			trans	-64.4	123.1	169.4	-60.5	171.7	0	0	0	107.4	W415 D432 V434	W415-I430 HydrophobicContact CE3-CG1 4.32Å; I430-D432 PolarHBondContact O-N 2.97Å; I430-V434 HydrophobicContact CG2-CB 3.75Å; I430-V434 HydrophobicContact CG2-CG1 3.94Å; I430-V434 HydrophobicContact CG2-CG2 4.46Å
431	P	58.4	Low	55.2	Low	37 Å²	37	95.7 Å²	95.7	24%	0.24	49%	0.49	C	S	.	.			trans	-55.5	140.2	176	-26.9	34.2	0	0	0	112.2	W415 A429 W433 V434 S435	W415-P431 HydrophobicContact CH2-CG 4.26Å; W415-P431 HydrophobicContact CZ3-CG 4.3Å; A429-P431 WeakPolarHBondContact O-CD 3.39Å; P431-W433 VanDerWaalsContact CB-CD1 3.45Å; P431-W433 HydrophobicContact CB-CG 4.36Å; P431-W433 VanDerWaalsContact CB-NE1 3.28Å; P431-W433 PolarHBondContact O-N 3.27Å; P431-W433 VanDerWaalsContact O-N 3.07Å; P431-V434 HydrophobicContact CB-CG2 4.4Å; P431-V434 WeakPolarHBondContact O-CB 3.3Å; P431-V434 PolarHBondContact O-N 3.46Å; P431-S435 PolarHBondContact O-N 3.06Å
432	D	60.5	Low	55.8	Low	133 Å²	133	101.4 Å²	101.4	71%	0.711	51%	0.513	S	S	*	.	H	α-helix	trans	-55.4	-32.9	-174.9	-65.4	-34.9	0	0	0	113.5	I430 V434 S435 E436	I430-D432 PolarHBondContact O-N 2.97Å; D432-V434 VanDerWaalsContact C-N 3.3Å; D432-V434 PolarHBondContact O-N 2.76Å; D432-S435 WeakPolarHBondContact O-CB 3.31Å; D432-S435 PolarHBondContact O-N 3.43Å; D432-E436 PolarHBondContact O-N 3.09Å
433	W	70.5	Confident	56.1	Low	138 Å²	138	100 Å²	100	52%	0.523	51%	0.505	S	S	.	.	H	α-helix	trans	-65.5	-30.6	178.5	68.9	-95.6	0	0	0	113.1	V412 P431 E436 L437	V412-W433 HydrophobicContact CG2-CH2 4.08Å; V412-W433 HydrophobicContact CG2-CZ3 4.16Å; P431-W433 VanDerWaalsContact CB-CD1 3.45Å; P431-W433 HydrophobicContact CB-CG 4.36Å; P431-W433 VanDerWaalsContact CB-NE1 3.28Å; P431-W433 PolarHBondContact O-N 3.27Å; P431-W433 VanDerWaalsContact O-N 3.07Å; W433-E436 PolarHBondContact O-N 3.22Å; W433-L437 HydrophobicContact CE3-CD1 3.55Å; W433-L437 HydrophobicContact CE3-CG 4.4Å; W433-L437 HydrophobicContact CZ3-CD1 3.51Å; W433-L437 WeakPolarHBondContact O-CG 3.18Å; W433-L437 PolarHBondContact O-N 3.26Å
434	V	61.1	Low	56.2	Low	4 Å²	4	95.8 Å²	95.8	2%	0.024	49%	0.493	C	S	.	.	H	α-helix	trans	-70.1	-43.3	174.9	-178.5	0	0	0	0	109.5	V412 I430 P431 D432 E436 L437 Q438	V412-V434 HydrophobicContact CG1-CG1 4.42Å; I430-V434 HydrophobicContact CG2-CB 3.75Å; I430-V434 HydrophobicContact CG2-CG1 3.94Å; I430-V434 HydrophobicContact CG2-CG2 4.46Å; P431-V434 HydrophobicContact CB-CG2 4.4Å; P431-V434 WeakPolarHBondContact O-CB 3.3Å; P431-V434 PolarHBondContact O-N 3.46Å; D432-V434 VanDerWaalsContact C-N 3.3Å; D432-V434 PolarHBondContact O-N 2.76Å; V434-E436 VanDerWaalsContact C-N 3.28Å; V434-E436 PolarHBondContact O-N 3.4Å; V434-L437 PolarHBondContact O-N 3.07Å; V434-Q438 PolarHBondContact O-N 2.97Å
435	S	62.9	Low	56.4	Low	39 Å²	39	99.7 Å²	99.7	27%	0.273	51%	0.51	S	S	.	.	H	α-helix	trans	-61.3	-37.4	174	-61	0	0	0	0	111.8	P431 D432 K439	P431-S435 PolarHBondContact O-N 3.06Å; D432-S435 WeakPolarHBondContact O-CB 3.31Å; D432-S435 PolarHBondContact O-N 3.43Å; S435-K439 WeakPolarHBondContact O-CG 3.19Å; S435-K439 PolarHBondContact O-N 3.26Å
436	E	62.1	Low	57.2	Low	102 Å²	102	102.5 Å²	102.5	48%	0.477	51%	0.514	S	S	.	.	H	α-helix	trans	-66.1	-40.5	173.2	-79.5	-158.7	-165.6	0	0	113.3	D432 W433 V434 Q438 K439 K440	D432-E436 PolarHBondContact O-N 3.09Å; W433-E436 PolarHBondContact O-N 3.22Å; V434-E436 VanDerWaalsContact C-N 3.28Å; V434-E436 PolarHBondContact O-N 3.4Å; E436-Q438 VanDerWaalsContact C-N 3.31Å; E436-Q438 PolarHBondContact O-N 2.79Å; E436-K439 PolarHBondContact O-N 3.09Å; E436-K440 WeakPolarHBondContact O-CB 3.17Å; E436-K440 WeakPolarHBondContact O-CG 3.3Å; E436-K440 PolarHBondContact O-N 3.14Å; E436-K440 IonicContact OE2-NZ 3.46Å; E436-K440 PolarHBondContact OE2-NZ 3.37Å
437	L	53.8	Low	57.6	Low	89 Å²	89	97.3 Å²	97.3	47%	0.466	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-41.3	176.6	-76.3	173	0	0	0	111.2	W433 V434 K440 S441	W433-L437 HydrophobicContact CE3-CD1 3.55Å; W433-L437 HydrophobicContact CE3-CG 4.4Å; W433-L437 HydrophobicContact CZ3-CD1 3.51Å; W433-L437 WeakPolarHBondContact O-CG 3.18Å; W433-L437 PolarHBondContact O-N 3.26Å; V434-L437 PolarHBondContact O-N 3.07Å; L437-K440 PolarHBondContact O-N 2.84Å; L437-S441 WeakPolarHBondContact O-CB 3.46Å; L437-S441 PolarHBondContact O-N 3.15Å
438	Q	61.4	Low	58	Low	86 Å²	86	96.7 Å²	96.7	40%	0.402	50%	0.499	S	S	.	.	H	α-helix	trans	-63.4	-47.1	174.8	-72.3	-177.1	-14.3	0	0	111.5	S416 V434 E436 K440 S441 F442	S416-Q438 PolarHBondContact OG-NE2 3.43Å; V434-Q438 PolarHBondContact O-N 2.97Å; E436-Q438 VanDerWaalsContact C-N 3.31Å; E436-Q438 PolarHBondContact O-N 2.79Å; Q438-K440 PolarHBondContact O-N 2.86Å; Q438-S441 PolarHBondContact O-N 2.92Å; Q438-S441 PolarHBondContact O-OG 3.15Å; Q438-F442 PolarHBondContact O-N 3.45Å; Q438-F442 VanDerWaalsContact O-N 3.14Å
439	K	61	Low	58.2	Low	153 Å²	153	89.9 Å²	89.9	67%	0.665	48%	0.475	S	S	*	.	H	α-helix	trans	-59.6	-42.9	175.9	-73.9	175	-177.8	175.5	0	112.5	S435 E436 F442 V443	S435-K439 WeakPolarHBondContact O-CG 3.19Å; S435-K439 PolarHBondContact O-N 3.26Å; E436-K439 PolarHBondContact O-N 3.09Å; K439-F442 PolarHBondContact O-N 3.5Å; K439-V443 WeakPolarHBondContact O-CG2 3.47Å; K439-V443 PolarHBondContact O-N 3.3Å
440	K	57	Low	58.2	Low	129 Å²	129	89.8 Å²	89.8	56%	0.561	47%	0.468	S	S	*	.	H	α-helix	trans	-66	-37.5	177.5	-77.9	167	174	154.1	0	111.9	E436 L437 Q438 F442 V443 C444	E436-K440 WeakPolarHBondContact O-CB 3.17Å; E436-K440 WeakPolarHBondContact O-CG 3.3Å; E436-K440 PolarHBondContact O-N 3.14Å; E436-K440 IonicContact OE2-NZ 3.46Å; E436-K440 PolarHBondContact OE2-NZ 3.37Å; L437-K440 PolarHBondContact O-N 2.84Å; Q438-K440 PolarHBondContact O-N 2.86Å; K440-F442 VanDerWaalsContact C-N 3.34Å; K440-F442 PolarHBondContact O-N 3.34Å; K440-V443 PolarHBondContact O-N 2.96Å; K440-C444 WeakPolarHBondContact O-CB 3.41Å; K440-C444 PolarHBondContact O-N 3.5Å
441	S	59.1	Low	58.2	Low	69 Å²	69	91 Å²	91	48%	0.483	47%	0.474	S	S	.	.	H	α-helix	trans	-61.6	-42.5	175.6	77.8	0	0	0	0	111.8	L437 Q438 C444 E445	L437-S441 WeakPolarHBondContact O-CB 3.46Å; L437-S441 PolarHBondContact O-N 3.15Å; Q438-S441 PolarHBondContact O-N 2.92Å; Q438-S441 PolarHBondContact O-OG 3.15Å; S441-C444 PolarHBondContact O-N 2.91Å; S441-E445 WeakPolarHBondContact O-CB 3.41Å; S441-E445 PolarHBondContact O-N 3.2Å
442	F	54.8	Low	58	Low	132 Å²	132	92.5 Å²	92.5	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-66.8	-39.1	178.6	-174.5	-99.5	0	0	0	112.8	Q438 K439 K440 K446	Q438-F442 PolarHBondContact O-N 3.45Å; Q438-F442 VanDerWaalsContact O-N 3.14Å; K439-F442 PolarHBondContact O-N 3.5Å; K440-F442 VanDerWaalsContact C-N 3.34Å; K440-F442 PolarHBondContact O-N 3.34Å; F442-K446 WeakPolarHBondContact O-CB 3.35Å; F442-K446 PolarHBondContact O-N 3.24Å
443	V	55.1	Low	57.6	Low	99 Å²	99	92.6 Å²	92.6	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-65.3	-41.5	175	175	0	0	0	0	111.1	K439 K440 K446 A447	K439-V443 WeakPolarHBondContact O-CG2 3.47Å; K439-V443 PolarHBondContact O-N 3.3Å; K440-V443 PolarHBondContact O-N 2.96Å; V443-K446 PolarHBondContact O-N 2.87Å; V443-A447 WeakPolarHBondContact O-CB 3.46Å; V443-A447 PolarHBondContact O-N 2.96Å
444	C	50.8	Low	56.5	Low	78 Å²	78	92.6 Å²	92.6	53%	0.527	49%	0.494	S	S	.	.	H	α-helix	trans	-66.6	-44.2	177.8	-162.7	0	0	0	0	111.3	K440 S441 K446 A447 V448	K440-C444 WeakPolarHBondContact O-CB 3.41Å; K440-C444 PolarHBondContact O-N 3.5Å; S441-C444 PolarHBondContact O-N 2.91Å; C444-K446 VanDerWaalsContact C-N 3.35Å; C444-K446 PolarHBondContact O-N 3.16Å; C444-A447 PolarHBondContact O-N 3.35Å; C444-V448 VanDerWaalsContact O-CG2 3.3Å; C444-V448 WeakPolarHBondContact O-CG2 3.37Å; C444-V448 PolarHBondContact O-N 3.41Å
445	E	55.5	Low	55.6	Low	123 Å²	123	101.5 Å²	101.5	58%	0.575	53%	0.527	S	S	*	.	H	α-helix	trans	-59.9	-45.6	175.3	-172	175.7	-173.2	0	0	111.2	S441 A447 V448 T449	S441-E445 WeakPolarHBondContact O-CB 3.41Å; S441-E445 PolarHBondContact O-N 3.2Å; E445-A447 PolarHBondContact O-N 2.88Å; E445-V448 PolarHBondContact O-N 3.25Å; E445-T449 WeakPolarHBondContact O-CG2 3.45Å; E445-T449 PolarHBondContact O-N 2.63Å; E445-T449 PolarHBondContact O-OG1 3.03Å
446	K	58.8	Low	54.8	Low	134 Å²	134	105.2 Å²	105.2	58%	0.583	54%	0.543	S	S	*	.	H	α-helix	trans	-58.7	-48.7	173.7	-166.9	173.6	-177.5	178.6	0	111	F442 V443 C444 V448 T449 T450	F442-K446 WeakPolarHBondContact O-CB 3.35Å; F442-K446 PolarHBondContact O-N 3.24Å; V443-K446 PolarHBondContact O-N 2.87Å; C444-K446 VanDerWaalsContact C-N 3.35Å; C444-K446 PolarHBondContact O-N 3.16Å; K446-V448 VanDerWaalsContact C-N 3.32Å; K446-V448 PolarHBondContact O-N 3.14Å; K446-T449 WeakPolarHBondContact CA-OG1 3.28Å; K446-T449 PolarHBondContact O-N 3.37Å; K446-T449 VanDerWaalsContact O-N 3.17Å; K446-T449 PolarHBondContact O-OG1 2.92Å; K446-T450 PolarHBondContact O-N 3.42Å; K446-T450 PolarHBondContact O-OG1 2.92Å
447	A	57.9	Low	53.9	Low	58 Å²	58	106.5 Å²	106.5	48%	0.479	55%	0.547	S	S	.	.	H	α-helix	trans	-59.1	-40.8	177.9	0	0	0	0	0	112.8	V443 C444 E445 T450 L451	V443-A447 WeakPolarHBondContact O-CB 3.46Å; V443-A447 PolarHBondContact O-N 2.96Å; C444-A447 PolarHBondContact O-N 3.35Å; E445-A447 PolarHBondContact O-N 2.88Å; A447-T450 PolarHBondContact O-N 3.33Å; A447-L451 VanDerWaalsContact O-CB 3.31Å; A447-L451 WeakPolarHBondContact O-CB 3.38Å; A447-L451 PolarHBondContact O-N 3.06Å
448	V	54.8	Low	53.1	Low	67 Å²	67	105.4 Å²	105.4	41%	0.406	55%	0.546	S	S	.	.	H	α-helix	trans	-65.8	-42.1	176.2	172.7	0	0	0	0	110.9	C444 E445 K446 L451 A452 F522	C444-V448 VanDerWaalsContact O-CG2 3.3Å; C444-V448 WeakPolarHBondContact O-CG2 3.37Å; C444-V448 PolarHBondContact O-N 3.41Å; E445-V448 PolarHBondContact O-N 3.25Å; K446-V448 VanDerWaalsContact C-N 3.32Å; K446-V448 PolarHBondContact O-N 3.14Å; V448-L451 PolarHBondContact O-N 3.26Å; V448-A452 WeakPolarHBondContact O-CB 3.49Å; V448-A452 PolarHBondContact O-N 3.32Å; V448-F522 HydrophobicContact CG1-CE2 4.44Å
449	T	56.1	Low	52.2	Low	68 Å²	68	108.8 Å²	108.8	42%	0.417	57%	0.566	S	S	.	*	H	α-helix	trans	-64.6	-40.4	175.3	60.9	0	0	0	0	112.2	E445 K446 L451 A452 N453	E445-T449 WeakPolarHBondContact O-CG2 3.45Å; E445-T449 PolarHBondContact O-N 2.63Å; E445-T449 PolarHBondContact O-OG1 3.03Å; K446-T449 WeakPolarHBondContact CA-OG1 3.28Å; K446-T449 PolarHBondContact O-N 3.37Å; K446-T449 VanDerWaalsContact O-N 3.17Å; K446-T449 PolarHBondContact O-OG1 2.92Å; T449-L451 VanDerWaalsContact C-N 3.32Å; T449-L451 PolarHBondContact O-N 3.24Å; T449-A452 PolarHBondContact O-N 2.91Å; T449-N453 WeakPolarHBondContact O-CB 3.34Å; T449-N453 PolarHBondContact O-N 2.93Å; T449-N453 PolarHBondContact O-ND2 2.92Å
450	T	56.1	Low	51	Low	70 Å²	70	105.6 Å²	105.6	43%	0.429	56%	0.563	S	S	.	*	H	α-helix	trans	-64.9	-38	174.4	-27.9	0	0	0	0	111.5	K446 A447 N453 K454	K446-T450 PolarHBondContact O-N 3.42Å; K446-T450 PolarHBondContact O-OG1 2.92Å; A447-T450 PolarHBondContact O-N 3.33Å; T450-N453 PolarHBondContact O-N 2.89Å; T450-K454 WeakPolarHBondContact O-CB 3.45Å; T450-K454 WeakPolarHBondContact O-CG 3.46Å; T450-K454 PolarHBondContact O-N 3.47Å
451	L	54.8	Low	50	Low	103 Å²	103	104.5 Å²	104.5	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-72.4	-33.1	177.8	-157.2	77.7	0	0	0	112.3	A447 V448 T449 I456	A447-L451 VanDerWaalsContact O-CB 3.31Å; A447-L451 WeakPolarHBondContact O-CB 3.38Å; A447-L451 PolarHBondContact O-N 3.06Å; V448-L451 PolarHBondContact O-N 3.26Å; T449-L451 VanDerWaalsContact C-N 3.32Å; T449-L451 PolarHBondContact O-N 3.24Å; L451-I456 HydrophobicContact CD1-CD1 3.41Å; L451-I456 VanDerWaalsContact CD1-CD1 3.41Å; L451-I456 HydrophobicContact CD2-CD1 4.49Å; L451-I456 HydrophobicContact CG-CD1 3.8Å
452	A	53.3	Low	49	Very low	69 Å²	69	107.2 Å²	107.2	57%	0.57	57%	0.573	S	S	*	*	H	α-helix	trans	-69.4	-35.4	172.8	0	0	0	0	0	111.5	V448 T449	V448-A452 WeakPolarHBondContact O-CB 3.49Å; V448-A452 PolarHBondContact O-N 3.32Å; T449-A452 PolarHBondContact O-N 2.91Å
453	N	52.4	Low	47.9	Very low	134 Å²	134	106.9 Å²	106.9	72%	0.717	58%	0.576	S	S	*	*	H	α-helix	trans	-77.3	-32.5	176.4	-70.1	-21.7	0	0	0	112.8	T449 T450 R455	T449-N453 WeakPolarHBondContact O-CB 3.34Å; T449-N453 PolarHBondContact O-N 2.93Å; T449-N453 PolarHBondContact O-ND2 2.92Å; T450-N453 PolarHBondContact O-N 2.89Å; N453-R455 PolarHBondContact O-N 2.86Å
454	K	47.1	Very low	46.9	Very low	138 Å²	138	106.9 Å²	106.9	60%	0.6	58%	0.578	S	S	*	*	S	Bend	trans	-67	104.2	164	-77.7	-175.8	174.6	-174.4	0	106.5	T450 I456	T450-K454 WeakPolarHBondContact O-CB 3.45Å; T450-K454 WeakPolarHBondContact O-CG 3.46Å; T450-K454 PolarHBondContact O-N 3.47Å; K454-I456 HydrophobicContact CB-CG1 4.26Å; K454-I456 PolarHBondContact O-N 3.23Å
455	R	43.6	Very low	45.8	Very low	191 Å²	191	111.8 Å²	111.8	72%	0.721	59%	0.591	S	S	*	*			trans	-61.6	78.3	166.7	-74.4	-178.3	172.9	171.2	-2.2	108.5	N453 K457	N453-R455 PolarHBondContact O-N 2.86Å; R455-K457 PolarHBondContact O-N 3.23Å
456	I	45.2	Very low	44.5	Very low	117 Å²	117	114.7 Å²	114.7	60%	0.6	61%	0.605	S	S	*	*			trans	-69.4	83.3	163.5	-57.6	179.4	0	0	0	103.8	L451 K454 C458	L451-I456 HydrophobicContact CD1-CD1 3.41Å; L451-I456 VanDerWaalsContact CD1-CD1 3.41Å; L451-I456 HydrophobicContact CD2-CD1 4.49Å; L451-I456 HydrophobicContact CG-CD1 3.8Å; K454-I456 HydrophobicContact CB-CG1 4.26Å; K454-I456 PolarHBondContact O-N 3.23Å; I456-C458 PolarHBondContact O-N 3.23Å
457	K	43.3	Very low	43	Very low	130 Å²	130	114.6 Å²	114.6	57%	0.565	61%	0.61	S	S	*	*			trans	-59.4	106.9	167.5	-69.4	178.2	-179.5	177	0	104.6	R455 L459 F462	R455-K457 PolarHBondContact O-N 3.23Å; K457-L459 PolarHBondContact O-N 2.99Å; K457-F462 HydrophobicContact CB-CD2 4.07Å; K457-F462 HydrophobicContact CB-CE2 3.75Å; K457-F462 HydrophobicContact CD-CD2 4.45Å; K457-F462 HydrophobicContact CD-CE2 3.47Å; K457-F462 VanDerWaalsContact CD-CE2 3.47Å; K457-F462 HydrophobicContact CD-CZ 3.92Å; K457-F462 HydrophobicContact CG-CE2 4.25Å
458	C	37.5	Very low	41.7	Very low	66 Å²	66	121 Å²	121	45%	0.446	63%	0.627	S	S	.	*			trans	-48.4	129	170.6	172.1	0	0	0	0	107.7	I456 S460 C461	I456-C458 PolarHBondContact O-N 3.23Å; C458-S460 PolarHBondContact O-N 2.91Å; C458-S460 VanDerWaalsContact O-N 3.08Å; C458-S460 WeakPolarHBondContact SG-CB 3.37Å; C458-S460 PolarHBondContact SG-N 3.41Å; C458-C461 WeakPolarHBondContact O-CA 3.37Å; C458-C461 WeakPolarHBondContact O-CB 3.39Å; C458-C461 PolarHBondContact O-N 3.49Å
459	L	43.2	Very low	40.3	Very low	156 Å²	156	126.7 Å²	126.7	82%	0.817	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-55	-25.4	174.5	-93.6	146.2	0	0	0	111.7	K457 C461 F462	K457-L459 PolarHBondContact O-N 2.99Å; L459-C461 VanDerWaalsContact C-N 3.28Å; L459-C461 PolarHBondContact O-N 3.43Å; L459-F462 WeakPolarHBondContact O-CB 3.38Å; L459-F462 PolarHBondContact O-N 2.85Å; L459-F462 VanDerWaalsContact O-N 3.09Å
460	S	34.9	Very low	38.9	Very low	87 Å²	87	128.5 Å²	128.5	61%	0.608	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-70.5	-19.1	172.8	-157.9	0	0	0	0	114.1	C458 F462	C458-S460 PolarHBondContact O-N 2.91Å; C458-S460 VanDerWaalsContact O-N 3.08Å; C458-S460 WeakPolarHBondContact SG-CB 3.37Å; C458-S460 PolarHBondContact SG-N 3.41Å; S460-F462 VanDerWaalsContact C-N 3.28Å
461	C	35.9	Very low	37.3	Very low	106 Å²	106	130.4 Å²	130.4	72%	0.716	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-83.7	-7.6	171	-61	0	0	0	0	112.4	C458 L459	C458-C461 WeakPolarHBondContact O-CA 3.37Å; C458-C461 WeakPolarHBondContact O-CB 3.39Å; C458-C461 PolarHBondContact O-N 3.49Å; L459-C461 VanDerWaalsContact C-N 3.28Å; L459-C461 PolarHBondContact O-N 3.43Å
462	F	37.6	Very low	35.9	Very low	125 Å²	125	134 Å²	134	55%	0.548	70%	0.697	S	S	.	*	G	3₁₀ helix	trans	-97.8	9.1	178.9	-102.9	-72.1	0	0	0	113.5	K457 L459 S460 P464	K457-F462 HydrophobicContact CB-CD2 4.07Å; K457-F462 HydrophobicContact CB-CE2 3.75Å; K457-F462 HydrophobicContact CD-CD2 4.45Å; K457-F462 HydrophobicContact CD-CE2 3.47Å; K457-F462 VanDerWaalsContact CD-CE2 3.47Å; K457-F462 HydrophobicContact CD-CZ 3.92Å; K457-F462 HydrophobicContact CG-CE2 4.25Å; L459-F462 WeakPolarHBondContact O-CB 3.38Å; L459-F462 PolarHBondContact O-N 2.85Å; L459-F462 VanDerWaalsContact O-N 3.09Å; S460-F462 VanDerWaalsContact C-N 3.28Å; F462-P464 WeakPolarHBondContact O-CD 3.36Å
463	I	31.5	Very low	34.5	Very low	125 Å²	125	140.3 Å²	140.3	64%	0.641	71%	0.712	S	S	*	*			trans	-68.5	104.3	168.3	-55.9	175.7	0	0	0	106.2	K465	I463-K465 PolarHBondContact O-N 3.33Å
464	P	34.4	Very low	33.4	Very low	99 Å²	99	139.7 Å²	139.7	64%	0.643	72%	0.716	S	S	*	*			trans	-65.7	123.2	174.6	-7.8	27.9	0	0	0	105	F462 E466	F462-P464 WeakPolarHBondContact O-CD 3.36Å; P464-E466 VanDerWaalsContact C-N 3.3Å; P464-E466 PolarHBondContact O-N 2.89Å
465	K	27.9	Very low	32.2	Very low	182 Å²	182	143.8 Å²	143.8	79%	0.791	73%	0.727	S	S	*	*			trans	-62.8	103.1	162.4	-74	-160.9	173.5	-169.5	0	105.9	I463 D467	I463-K465 PolarHBondContact O-N 3.33Å; K465-D467 PolarHBondContact O-N 3.27Å
466	E	28.4	Very low	31.3	Very low	184 Å²	184	139.2 Å²	139.2	86%	0.86	73%	0.731	S	S	*	*			trans	-70.2	77.3	167.6	-71.4	-164.2	163.1	0	0	108.1	P464 K468	P464-E466 VanDerWaalsContact C-N 3.3Å; P464-E466 PolarHBondContact O-N 2.89Å; E466-K468 PolarHBondContact O-N 2.95Å
467	D	27	Very low	30.4	Very low	131 Å²	131	138.6 Å²	138.6	70%	0.701	73%	0.732	S	S	*	*			trans	-76.5	94	156.9	-65	-34.5	0	0	0	106	K465	K465-D467 PolarHBondContact O-N 3.27Å
468	K	30.3	Very low	29.7	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	75%	0.746	S	S	*	*			trans	-175.1	99.1	149	-97.5	149.6	-163.9	-171.8	0	111.4	E466	E466-K468 PolarHBondContact O-N 2.95Å
469	E	26.7	Very low	29.1	Very low	186 Å²	186	145 Å²	145	87%	0.869	76%	0.762	S	S	*	*			trans	-41	147.5	137.7	-76.5	173.2	129.3	0	0	111.1
470	S	26.4	Very low	28.2	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	76%	0.759	S	S	*	*			trans	74.7	95.6	172.8	76.6	0	0	0	0	115.9
471	S	22.9	Very low	27.9	Very low	110 Å²	110	142.9 Å²	142.9	77%	0.769	77%	0.766	S	S	*	*				157.5	127.2	90.7	53.6	0	0	0	0	110.2
472	M	25.3	Very low	27.3	Very low	178 Å²	178	147.1 Å²	147.1	88%	0.877	78%	0.775	S	S	*	*			trans	59.5	86.5	143.8	-141.2	155.3	-170.1	0	0	115.9	P474	M472-P474 WeakPolarHBondContact O-CD 3.22Å; M472-P474 VanDerWaalsContact O-N 3.09Å
473	F	23.1	Very low	26.8	Very low	202 Å²	202	145.6 Å²	145.6	89%	0.886	79%	0.785	S	S	*	*			trans	-38.3	118.1	153.9	-83.3	-91.5	0	0	0	109.9	R475	F473-R475 VanDerWaalsContact C-N 3.29Å; F473-R475 PolarHBondContact O-N 3.4Å
474	P	28.8	Very low	26.4	Very low	122 Å²	122	143.6 Å²	143.6	79%	0.792	80%	0.796	S	S	*	*			trans	-69.7	97.3	167.5	-5	20.6	0	0	0	106.1	M472 A476	M472-P474 WeakPolarHBondContact O-CD 3.22Å; M472-P474 VanDerWaalsContact O-N 3.09Å; P474-A476 PolarHBondContact O-N 3.4Å
475	R	21.3	Very low	26	Very low	224 Å²	224	143.6 Å²	143.6	85%	0.845	80%	0.804	S	S	*	*			trans	-67.3	75.6	166.7	-171.3	177.7	-167.7	159.3	2.7	107.5	F473 T477	F473-R475 VanDerWaalsContact C-N 3.29Å; F473-R475 PolarHBondContact O-N 3.4Å; R475-T477 HydrophobicContact CG-CG2 4.39Å; R475-T477 PolarHBondContact O-N 3.26Å
476	A	26.6	Very low	25.9	Very low	95 Å²	95	139.2 Å²	139.2	79%	0.785	80%	0.796	S	S	*	*			trans	-80.4	78.4	169.3	0	0	0	0	0	108.1	P474 H478	P474-A476 PolarHBondContact O-N 3.4Å; A476-H478 PolarHBondContact O-N 2.93Å
477	T	24.8	Very low	26	Very low	103 Å²	103	137 Å²	137	63%	0.632	80%	0.795	S	S	*	*			trans	-62.4	105.6	151.7	39.4	0	0	0	0	107.5	R475	R475-T477 HydrophobicContact CG-CG2 4.39Å; R475-T477 PolarHBondContact O-N 3.26Å
478	H	29	Very low	26.1	Very low	185 Å²	185	137.9 Å²	137.9	86%	0.856	80%	0.799	S	S	*	*			trans	-147.8	122.4	148.3	-99.4	-73.3	0	0	0	109.7	A476	A476-H478 PolarHBondContact O-N 2.93Å
479	D	24.5	Very low	26.1	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	79%	0.79	S	S	*	*			trans	-58.5	150.6	178.9	-61.1	-67	0	0	0	113.8
480	S	24.1	Very low	26.3	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	79%	0.792	S	S	*	*			trans	31.9	102.3	131.4	-168.8	0	0	0	0	117.5
481	A	28.7	Very low	26.7	Very low	92 Å²	92	133.1 Å²	133.1	76%	0.76	79%	0.789	S	S	*	*			trans	-152.5	112.7	142.4	0	0	0	0	0	109.6	A483	A481-A483 PolarHBondContact O-N 3.42Å
482	H	23.7	Very low	27.2	Very low	194 Å²	194	139.3 Å²	139.3	90%	0.898	80%	0.795	S	S	*	*			trans	-51.5	105.8	163.6	-68	-90.1	0	0	0	110.2
483	A	28.1	Very low	27.6	Very low	94 Å²	94	136.5 Å²	136.5	78%	0.777	78%	0.78	S	S	*	*			trans	-117.1	93.1	160.3	0	0	0	0	0	106.8	A481 A485	A481-A483 PolarHBondContact O-N 3.42Å; A483-A485 PolarHBondContact O-N 3.34Å
484	G	21.3	Very low	28.3	Very low	83 Å²	83	130.8 Å²	130.8	86%	0.856	77%	0.77	S	S	*	*			trans	-58.2	108.1	167.7	0	0	0	0	0	108.6	S486	G484-S486 PolarHBondContact O-N 2.92Å
485	A	26.3	Very low	28.5	Very low	98 Å²	98	132.4 Å²	132.4	81%	0.81	77%	0.766	S	S	*	*			trans	-78.3	106.3	166.2	0	0	0	0	0	107.1	A483	A483-A485 PolarHBondContact O-N 3.34Å
486	S	27.1	Very low	29.4	Very low	90 Å²	90	127.6 Å²	127.6	63%	0.629	75%	0.754	S	S	*	*			trans	-32.6	136.3	165.4	-178.7	0	0	0	0	112.7	G484 D488	G484-S486 PolarHBondContact O-N 2.92Å; S486-D488 PolarHBondContact O-N 2.8Å
487	V	29	Very low	30	Very low	139 Å²	139	131.2 Å²	131.2	84%	0.842	75%	0.751	S	S	*	*			trans	-68.9	77	168.8	-175.1	0	0	0	0	107.7	S489	V487-S489 PolarHBondContact O-N 2.82Å
488	D	29.4	Very low	30.8	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	75%	0.747	S	S	*	*			trans	-80.7	107.4	171.7	-96.7	-19.7	0	0	0	110	S486 H490	S486-D488 PolarHBondContact O-N 2.8Å; D488-H490 PolarHBondContact O-N 3.13Å
489	S	30.9	Very low	31.2	Very low	93 Å²	93	126 Å²	126	65%	0.65	73%	0.729	S	S	*	*			trans	-39	121.9	169.5	-56.2	0	0	0	0	113.4	V487 S491	V487-S489 PolarHBondContact O-N 2.82Å; S489-S491 PolarHBondContact O-N 3.2Å
490	H	31.1	Very low	32	Very low	197 Å²	197	122 Å²	122	91%	0.912	72%	0.716	S	S	*	*			trans	33.8	66.8	138.6	-63.6	68.7	0	0	0	116.2	D488	D488-H490 PolarHBondContact O-N 3.13Å
491	S	35.6	Very low	32.6	Very low	95 Å²	95	122.1 Å²	122.1	66%	0.664	71%	0.708	S	S	*	*			trans	-101.7	130.2	165.5	-177.1	0	0	0	0	110.8	S489 H493	S489-S491 PolarHBondContact O-N 3.2Å; S491-H493 VanDerWaalsContact C-N 3.29Å; S491-H493 PolarHBondContact O-N 3.19Å
492	R	31.8	Very low	33.1	Very low	241 Å²	241	123.8 Å²	123.8	91%	0.909	70%	0.7	S	S	*	*			trans	-77.3	51.6	-158.8	-161.1	-175.7	-76	179	-6.5	113.5
493	H	35.4	Very low	33.8	Very low	119 Å²	119	120.2 Å²	120.2	55%	0.551	69%	0.687	S	S	*	*			trans	-110.6	15.5	-169.8	-91.4	-49.2	0	0	0	117.2	S491 E496	S491-H493 VanDerWaalsContact C-N 3.29Å; S491-H493 PolarHBondContact O-N 3.19Å; H493-E496 IonicContact CE1-OE2 2.76Å; H493-E496 PolarHBondContact CE1-OE2 3.47Å; H493-E496 IonicContact ND1-OE2 3.93Å; H493-E496 PolarHBondContact ND1-OE2 3.08Å
494	A	36.3	Very low	34.2	Very low	81 Å²	81	122.1 Å²	122.1	67%	0.669	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-24.7	175.7	0	0	0	0	0	113.9
495	H	34.1	Very low	34.9	Very low	156 Å²	156	124 Å²	124	72%	0.722	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-23.5	-175.1	-79.3	-77.9	0	0	0	114.8	K497 V498	H495-K497 PolarHBondContact O-N 3.24Å; H495-V498 PolarHBondContact O-N 3.27Å
496	E	38.9	Very low	35.3	Very low	124 Å²	124	126.1 Å²	126.1	58%	0.579	67%	0.668	S	S	*	*	H	α-helix	trans	-74.8	-24.8	-176.3	-164.9	172	-176.3	0	0	113.2	H493 V498 A500	H493-E496 IonicContact CE1-OE2 2.76Å; H493-E496 PolarHBondContact CE1-OE2 3.47Å; H493-E496 IonicContact ND1-OE2 3.93Å; H493-E496 PolarHBondContact ND1-OE2 3.08Å; E496-V498 VanDerWaalsContact C-N 3.33Å; E496-V498 PolarHBondContact O-N 3.44Å; E496-A500 PolarHBondContact O-N 3.22Å
497	K	39	Very low	35.7	Very low	170 Å²	170	125.9 Å²	125.9	74%	0.739	67%	0.671	S	S	*	*	H	α-helix	trans	-75.8	-19.2	176.3	-77.1	-173.1	176.3	-177.7	0	113.9	H495	H495-K497 PolarHBondContact O-N 3.24Å
498	V	41.6	Very low	35.7	Very low	88 Å²	88	125.2 Å²	125.2	53%	0.533	66%	0.659	S	S	.	*	H	α-helix	trans	-81.3	-42.6	177.4	-174.7	0	0	0	0	109.9	H495 E496 A500 L501 E502	H495-V498 PolarHBondContact O-N 3.27Å; E496-V498 VanDerWaalsContact C-N 3.33Å; E496-V498 PolarHBondContact O-N 3.44Å; V498-A500 VanDerWaalsContact C-N 3.3Å; V498-A500 PolarHBondContact O-N 3.14Å; V498-L501 PolarHBondContact O-N 3.16Å; V498-L501 VanDerWaalsContact O-N 3.11Å; V498-E502 PolarHBondContact O-N 3.29Å
499	D	38.3	Very low	35.5	Very low	92 Å²	92	123 Å²	123	49%	0.492	66%	0.655	S	S	.	*	H	α-helix	trans	-66.3	-32.5	178.1	-64.5	-15.9	0	0	0	112.3	N503	D499-N503 PolarHBondContact O-N 3.17Å; D499-N503 VanDerWaalsContact O-N 3.15Å; D499-N503 PolarHBondContact O-ND2 3.05Å
500	A	42.1	Very low	35.2	Very low	60 Å²	60	124.8 Å²	124.8	50%	0.496	66%	0.655	S	S	.	*	H	α-helix	trans	-65.2	-38.8	173.1	0	0	0	0	0	112.1	E496 V498 E504	E496-A500 PolarHBondContact O-N 3.22Å; V498-A500 VanDerWaalsContact C-N 3.3Å; V498-A500 PolarHBondContact O-N 3.14Å; A500-E504 WeakPolarHBondContact O-CB 3.49Å; A500-E504 PolarHBondContact O-N 3.08Å; A500-E504 VanDerWaalsContact O-N 3.12Å
501	L	36.7	Very low	34.8	Very low	111 Å²	111	121 Å²	121	58%	0.581	65%	0.645	S	S	*	*	H	α-helix	trans	-74.8	-33.9	-179.8	-124.9	110.8	0	0	0	112.3	V498 E504 L505	V498-L501 PolarHBondContact O-N 3.16Å; V498-L501 VanDerWaalsContact O-N 3.11Å; L501-E504 PolarHBondContact O-N 3.15Å; L501-L505 PolarHBondContact O-N 2.77Å; L501-L505 VanDerWaalsContact O-N 3.14Å
502	E	38.5	Very low	34.4	Very low	127 Å²	127	122.1 Å²	122.1	59%	0.593	64%	0.643	S	S	*	*	H	α-helix	trans	-69.3	-39	177.8	-150.4	165.5	-150.7	0	0	110.9	V498 L505 D506	V498-E502 PolarHBondContact O-N 3.29Å; E502-L505 PolarHBondContact O-N 3.41Å; E502-D506 PolarHBondContact O-N 3.31Å
503	N	38.5	Very low	34	Very low	118 Å²	118	115.6 Å²	115.6	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-71.4	-31.6	174.5	-74.4	-54.5	0	0	0	113.7	D499 A507	D499-N503 PolarHBondContact O-N 3.17Å; D499-N503 VanDerWaalsContact O-N 3.15Å; D499-N503 PolarHBondContact O-ND2 3.05Å; N503-A507 PolarHBondContact O-N 2.84Å
504	E	36.6	Very low	33.6	Very low	134 Å²	134	115.7 Å²	115.7	63%	0.626	64%	0.639	S	S	*	*	H	α-helix	trans	-74.4	-29.1	177.5	-147.9	177.7	-170	0	0	112	A500 L501 A507 Q508	A500-E504 WeakPolarHBondContact O-CB 3.49Å; A500-E504 PolarHBondContact O-N 3.08Å; A500-E504 VanDerWaalsContact O-N 3.12Å; L501-E504 PolarHBondContact O-N 3.15Å; E504-A507 PolarHBondContact O-N 2.99Å; E504-Q508 PolarHBondContact O-N 3.12Å
505	L	35.9	Very low	33	Very low	122 Å²	122	115.8 Å²	115.8	64%	0.639	65%	0.648	S	S	*	*	H	α-helix	trans	-71.2	-35.8	174.7	-85.1	160.6	0	0	0	112.9	L501 E502 A507 Q508	L501-L505 PolarHBondContact O-N 2.77Å; L501-L505 VanDerWaalsContact O-N 3.14Å; E502-L505 PolarHBondContact O-N 3.41Å; L505-A507 VanDerWaalsContact C-N 3.29Å; L505-A507 PolarHBondContact O-N 3.28Å; L505-Q508 PolarHBondContact O-N 3.15Å
506	D	35.1	Very low	32.8	Very low	144 Å²	144	117 Å²	117	77%	0.77	65%	0.651	S	S	*	*	H	α-helix	trans	-71.8	-23.1	175.9	-86.7	-12.7	0	0	0	112.9	E502	E502-D506 PolarHBondContact O-N 3.31Å
507	A	35	Very low	32.5	Very low	85 Å²	85	115.8 Å²	115.8	70%	0.702	66%	0.662	S	S	*	*	H	α-helix	trans	-82.5	-20.7	176.8	0	0	0	0	0	113.6	N503 E504 L505 S509	N503-A507 PolarHBondContact O-N 2.84Å; E504-A507 PolarHBondContact O-N 2.99Å; L505-A507 VanDerWaalsContact C-N 3.29Å; L505-A507 PolarHBondContact O-N 3.28Å; A507-S509 PolarHBondContact O-N 3.26Å
508	Q	28.7	Very low	32.1	Very low	124 Å²	124	110.6 Å²	110.6	58%	0.579	66%	0.657	S	S	*	*			trans	-100	75.7	177.8	-96.2	173.7	12.7	0	0	111.8	E504 L505 M510	E504-Q508 PolarHBondContact O-N 3.12Å; L505-Q508 PolarHBondContact O-N 3.15Å; Q508-M510 PolarHBondContact O-N 2.83Å
509	S	25.2	Very low	31.5	Very low	101 Å²	101	112.7 Å²	112.7	71%	0.706	67%	0.67	S	S	*	*			trans	-61.2	71.8	156.3	163.4	0	0	0	0	109.9	A507 V511	A507-S509 PolarHBondContact O-N 3.26Å; S509-V511 VanDerWaalsContact C-N 3.27Å; S509-V511 PolarHBondContact O-N 2.82Å
510	M	25.1	Very low	31	Very low	132 Å²	132	113.4 Å²	113.4	65%	0.65	67%	0.674	S	S	*	*			trans	-76.2	87.4	167.5	-77.4	-162.2	176	0	0	108.3	Q508 L512	Q508-M510 PolarHBondContact O-N 2.83Å; M510-L512 HydrophobicContact CB-CD1 4.37Å; M510-L512 HydrophobicContact CB-CG 4.3Å; M510-L512 PolarHBondContact O-N 3.43Å; M510-L512 HydrophobicContact SD-CD1 4.24Å
511	V	23.5	Very low	30.5	Very low	117 Å²	117	117.4 Å²	117.4	71%	0.709	69%	0.686	S	S	*	*			trans	-65	82.7	163.5	-176.8	0	0	0	0	107.3	S509	S509-V511 VanDerWaalsContact C-N 3.27Å; S509-V511 PolarHBondContact O-N 2.82Å
512	L	26.3	Very low	30.3	Very low	119 Å²	119	119.1 Å²	119.1	62%	0.623	69%	0.689	S	S	*	*			trans	-109.2	86	172.7	-69.1	177.3	0	0	0	108.8	M510 N514	M510-L512 HydrophobicContact CB-CD1 4.37Å; M510-L512 HydrophobicContact CB-CG 4.3Å; M510-L512 PolarHBondContact O-N 3.43Å; M510-L512 HydrophobicContact SD-CD1 4.24Å; L512-N514 PolarHBondContact O-N 3.39Å
513	S	23.4	Very low	30.2	Very low	104 Å²	104	117 Å²	117	73%	0.727	69%	0.688	S	S	*	*			trans	-55.8	82.1	159.4	40.4	0	0	0	0	110.5
514	N	26.9	Very low	30	Very low	120 Å²	120	116.8 Å²	116.8	64%	0.642	68%	0.682	S	S	*	*			trans	-133.7	92	162.1	-93.9	6.6	0	0	0	107.9	L512 F516	L512-N514 PolarHBondContact O-N 3.39Å; N514-F516 VanDerWaalsContact C-N 3.26Å; N514-F516 HydrophobicContact CB-CD2 4.45Å; N514-F516 PolarHBondContact O-N 3.48Å
515	G	24.9	Very low	29.6	Very low	83 Å²	83	118.1 Å²	118.1	86%	0.856	68%	0.681	S	S	*	*			trans	-68.5	80.7	172.4	0	0	0	0	0	110.9	A517	G515-A517 PolarHBondContact O-N 2.81Å
516	F	27.9	Very low	29.6	Very low	183 Å²	183	117.3 Å²	117.3	80%	0.803	68%	0.677	S	S	*	*			trans	-80.5	108.5	155.4	-82.1	-86.8	0	0	0	106.8	N514 G518	N514-F516 VanDerWaalsContact C-N 3.26Å; N514-F516 HydrophobicContact CB-CD2 4.45Å; N514-F516 PolarHBondContact O-N 3.48Å; F516-G518 PolarHBondContact O-N 3.4Å
517	A	33.6	Very low	29.9	Very low	98 Å²	98	118.1 Å²	118.1	81%	0.81	68%	0.682	S	S	*	*			trans	-59.9	86.6	175.5	0	0	0	0	0	109.4	G515 T519	G515-A517 PolarHBondContact O-N 2.81Å; A517-T519 PolarHBondContact O-N 3.42Å; A517-T519 VanDerWaalsContact O-N 3.11Å
518	G	29.5	Very low	29.6	Very low	60 Å²	60	116.8 Å²	116.8	62%	0.619	68%	0.677	S	S	*	*			trans	-57.8	115.7	166.4	0	0	0	0	0	107.4	F516 N520	F516-G518 PolarHBondContact O-N 3.4Å; G518-N520 VanDerWaalsContact C-N 3.26Å; G518-N520 PolarHBondContact O-N 2.86Å
519	T	30.5	Very low	29.6	Very low	133 Å²	133	117.1 Å²	117.1	82%	0.816	68%	0.682	S	S	*	*			trans	-58.3	90.2	174.4	49.2	0	0	0	0	108.4	A517 L521	A517-T519 PolarHBondContact O-N 3.42Å; A517-T519 VanDerWaalsContact O-N 3.11Å; T519-L521 PolarHBondContact O-N 3.21Å; T519-L521 VanDerWaalsContact O-N 3.07Å
520	N	27.9	Very low	29.7	Very low	107 Å²	107	121.7 Å²	121.7	57%	0.572	68%	0.683	S	S	*	*			trans	-53.9	119	171.2	-90.7	-31.1	0	0	0	107.1	G518 F522 S523	G518-N520 VanDerWaalsContact C-N 3.26Å; G518-N520 PolarHBondContact O-N 2.86Å; N520-F522 PolarHBondContact O-N 3.49Å; N520-S523 WeakPolarHBondContact O-CB 3.41Å; N520-S523 PolarHBondContact O-N 3.18Å; N520-S523 PolarHBondContact O-OG 3.37Å
521	L	31.6	Very low	30.1	Very low	144 Å²	144	119 Å²	119	75%	0.754	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.8	-9.8	174.1	-101.2	111	0	0	0	112.8	T519 F524	T519-L521 PolarHBondContact O-N 3.21Å; T519-L521 VanDerWaalsContact O-N 3.07Å; L521-F524 WeakPolarHBondContact O-CD2 3.49Å
522	F	32.2	Very low	30.6	Very low	147 Å²	147	121.6 Å²	121.6	65%	0.645	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-6.1	177.1	-59	-74.2	0	0	0	114.4	V448 N520 F524 W525	V448-F522 HydrophobicContact CG1-CE2 4.44Å; N520-F522 PolarHBondContact O-N 3.49Å; F522-F524 PolarHBondContact O-N 2.94Å; F522-F524 VanDerWaalsContact O-N 3.1Å; F522-W525 PolarHBondContact O-N 3.07Å
523	S	35.7	Very low	30.8	Very low	82 Å²	82	120.4 Å²	120.4	57%	0.573	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-4.7	178.3	-61.2	0	0	0	0	114.4	N520 W525	N520-S523 WeakPolarHBondContact O-CB 3.41Å; N520-S523 PolarHBondContact O-N 3.18Å; N520-S523 PolarHBondContact O-OG 3.37Å; S523-W525 PolarHBondContact O-N 3.06Å
524	F	34.2	Very low	30.9	Very low	113 Å²	113	123.7 Å²	123.7	50%	0.496	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.6	-8	178.6	-68	-74.5	0	0	0	114	L521 F522 R530 V531	L521-F524 WeakPolarHBondContact O-CD2 3.49Å; F522-F524 PolarHBondContact O-N 2.94Å; F522-F524 VanDerWaalsContact O-N 3.1Å; F524-R530 WeakPolarHBondContact O-CA 3.39Å; F524-V531 PolarHBondContact O-N 3.19Å
525	W	28.3	Very low	31	Very low	163 Å²	163	123.1 Å²	123.1	62%	0.617	68%	0.684	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.3	105.5	-178.2	-56	90.8	0	0	0	108.8	F522 S523	F522-W525 PolarHBondContact O-N 3.07Å; S523-W525 PolarHBondContact O-N 3.06Å
526	N	37.3	Very low	31.1	Very low	104 Å²	104	124.3 Å²	124.3	56%	0.556	68%	0.677	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.9	115.5	161.3	-166.7	11.4	0	0	0	107.1	G528 L529 V531	N526-G528 VanDerWaalsContact C-N 3.27Å; N526-G528 PolarHBondContact O-N 2.91Å; N526-G528 VanDerWaalsContact O-N 3.15Å; N526-L529 PolarHBondContact N-O 2.98Å; N526-L529 PolarHBondContact O-N 2.94Å; N526-V531 HydrophobicContact CB-CG2 3.75Å
527	N	39.7	Very low	31.1	Very low	161 Å²	161	124.7 Å²	124.7	86%	0.861	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.5	42.9	-178.9	-65.5	-6.7	0	0	0	115	L529	N527-L529 PolarHBondContact O-N 3.37Å
528	G	30	Very low	30.7	Very low	58 Å²	58	125.7 Å²	125.7	60%	0.598	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	77	-0	177.8	0	0	0	0	0	115.2	N526	N526-G528 VanDerWaalsContact C-N 3.27Å; N526-G528 PolarHBondContact O-N 2.91Å; N526-G528 VanDerWaalsContact O-N 3.15Å
529	L	28.5	Very low	30.5	Very low	130 Å²	130	127.5 Å²	127.5	68%	0.681	68%	0.684	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.6	134.3	171.5	-69.3	169.7	0	0	0	110.4	N526 N527 V531	N526-L529 PolarHBondContact N-O 2.98Å; N526-L529 PolarHBondContact O-N 2.94Å; N527-L529 PolarHBondContact O-N 3.37Å; L529-V531 PolarHBondContact O-N 2.92Å
530	R	27.6	Very low	30.2	Very low	197 Å²	197	128 Å²	128	74%	0.743	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.1	111.3	174.3	-152.4	179.5	-163.6	-166.5	3.3	107.8	F524 H532	F524-R530 WeakPolarHBondContact O-CA 3.39Å; R530-H532 PolarHBondContact O-N 3.5Å; R530-H532 VanDerWaalsContact O-N 3.12Å
531	V	33	Very low	30	Very low	75 Å²	75	130.7 Å²	130.7	46%	0.455	69%	0.689	S	S	.	*			trans	-71.8	109.7	176.2	-173.1	0	0	0	0	107.3	F524 N526 L529 S533	F524-V531 PolarHBondContact O-N 3.19Å; N526-V531 HydrophobicContact CB-CG2 3.75Å; L529-V531 PolarHBondContact O-N 2.92Å; V531-S533 PolarHBondContact O-N 3.4Å
532	H	33	Very low	29.8	Very low	172 Å²	172	130.8 Å²	130.8	80%	0.796	69%	0.689	S	S	*	*			trans	-62.7	109.2	164.3	-79	-87.3	0	0	0	106.4	R530 Q534	R530-H532 PolarHBondContact O-N 3.5Å; R530-H532 VanDerWaalsContact O-N 3.12Å; H532-Q534 VanDerWaalsContact C-N 3.26Å; H532-Q534 PolarHBondContact O-N 3.32Å
533	S	31.6	Very low	29.3	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	70%	0.696	S	S	*	*			trans	-61.6	97.1	170.9	58.6	0	0	0	0	107.1	V531 V535	V531-S533 PolarHBondContact O-N 3.4Å; S533-V535 PolarHBondContact O-N 3.23Å
534	Q	26.1	Very low	28.9	Very low	173 Å²	173	135.4 Å²	135.4	81%	0.808	71%	0.707	S	S	*	*			trans	-70.2	93.9	169.4	-151.6	153.9	19.7	0	0	104.6	H532 P536	H532-Q534 VanDerWaalsContact C-N 3.26Å; H532-Q534 PolarHBondContact O-N 3.32Å; Q534-P536 WeakPolarHBondContact O-CD 3.38Å; Q534-P536 VanDerWaalsContact O-N 3.16Å
535	V	27.2	Very low	28.7	Very low	108 Å²	108	134.6 Å²	134.6	66%	0.655	72%	0.715	S	S	*	*			trans	-54	122.9	172.2	-178.4	0	0	0	0	105.2	S533 F537	S533-V535 PolarHBondContact O-N 3.23Å; V535-F537 PolarHBondContact O-N 3.18Å
536	P	28.7	Very low	28.5	Very low	108 Å²	108	135 Å²	135	70%	0.701	72%	0.724	S	S	*	*			trans	-57	115.9	179.7	-19.6	29.4	0	0	0	107.4	Q534 T538	Q534-P536 WeakPolarHBondContact O-CD 3.38Å; Q534-P536 VanDerWaalsContact O-N 3.16Å; P536-T538 PolarHBondContact O-N 2.9Å
537	F	26.8	Very low	28.2	Very low	192 Å²	192	134.3 Å²	134.3	84%	0.842	73%	0.725	S	S	*	*			trans	-60.1	99.7	161.4	-70.7	-87.5	0	0	0	105	V535 A539	V535-F537 PolarHBondContact O-N 3.18Å; F537-A539 PolarHBondContact O-N 3.37Å
538	T	24.8	Very low	27.8	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	72%	0.723	S	S	*	*			trans	-56.8	113.9	160	38.2	0	0	0	0	104.6	P536 I540	P536-T538 PolarHBondContact O-N 2.9Å; T538-I540 VanDerWaalsContact C-N 3.27Å; T538-I540 PolarHBondContact O-N 2.93Å
539	A	25.7	Very low	27.8	Very low	98 Å²	98	139.7 Å²	139.7	81%	0.81	73%	0.732	S	S	*	*			trans	-54.5	102	170.4	0	0	0	0	0	105.9	F537 H541	F537-A539 PolarHBondContact O-N 3.37Å; A539-H541 VanDerWaalsContact C-N 3.31Å; A539-H541 PolarHBondContact O-N 2.87Å
540	I	25.4	Very low	27.8	Very low	144 Å²	144	140.7 Å²	140.7	74%	0.738	74%	0.737	S	S	*	*			trans	-63.8	105.6	174.4	-63.2	173.6	0	0	0	103.3	T538 I542	T538-I540 VanDerWaalsContact C-N 3.27Å; T538-I540 PolarHBondContact O-N 2.93Å; I540-I542 PolarHBondContact O-N 2.76Å
541	H	23.5	Very low	27.8	Very low	163 Å²	163	137 Å²	137	76%	0.755	74%	0.742	S	S	*	*			trans	-62.9	93.4	172.8	-162.3	-64.9	0	0	0	105.3	A539 R543	A539-H541 VanDerWaalsContact C-N 3.31Å; A539-H541 PolarHBondContact O-N 2.87Å; H541-R543 PolarHBondContact O-N 2.88Å
542	I	26.3	Very low	27.6	Very low	146 Å²	146	139.5 Å²	139.5	75%	0.749	76%	0.761	S	S	*	*			trans	-62.9	93.4	173.5	-58.8	171.9	0	0	0	104.3	I540 S544	I540-I542 PolarHBondContact O-N 2.76Å; I542-S544 VanDerWaalsContact C-N 3.3Å; I542-S544 PolarHBondContact O-N 3.44Å
543	R	22.7	Very low	27.4	Very low	210 Å²	210	134.6 Å²	134.6	79%	0.792	76%	0.757	S	S	*	*			trans	-65.4	106.1	162.6	-79.1	-170.7	167.4	175.9	-2.7	104.3	H541 S545	H541-R543 PolarHBondContact O-N 2.88Å; R543-S545 PolarHBondContact O-N 2.92Å
544	S	26.5	Very low	27.1	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	76%	0.756	S	S	*	*			trans	-59.3	65.9	161.4	49.8	0	0	0	0	109.2	I542 E546	I542-S544 VanDerWaalsContact C-N 3.3Å; I542-S544 PolarHBondContact O-N 3.44Å; S544-E546 VanDerWaalsContact C-N 3.26Å; S544-E546 PolarHBondContact O-N 3.47Å
545	S	29.4	Very low	27.3	Very low	96 Å²	96	139 Å²	139	67%	0.671	76%	0.761	S	S	*	*			trans	-88.2	86.8	153.1	55.6	0	0	0	0	104.7	R543 P547	R543-S545 PolarHBondContact O-N 2.92Å; S545-P547 WeakPolarHBondContact O-CD 3.29Å; S545-P547 VanDerWaalsContact O-N 3.15Å
546	E	25.5	Very low	27.4	Very low	173 Å²	173	139.9 Å²	139.9	81%	0.808	76%	0.762	S	S	*	*			trans	-47	116.2	170.3	-156.8	164.5	-162	0	0	107.7	S544 V548	S544-E546 VanDerWaalsContact C-N 3.26Å; S544-E546 PolarHBondContact O-N 3.47Å; E546-V548 PolarHBondContact O-N 2.88Å
547	P	30.5	Very low	27.5	Very low	89 Å²	89	142.2 Å²	142.2	58%	0.578	77%	0.769	S	S	*	*			trans	-64.4	114.4	178.2	24.2	-30.1	0	0	0	107	S545 Y549	S545-P547 WeakPolarHBondContact O-CD 3.29Å; S545-P547 VanDerWaalsContact O-N 3.15Å; P547-Y549 VanDerWaalsContact C-N 3.25Å; P547-Y549 HydrophobicContact CB-CD2 4.49Å; P547-Y549 HydrophobicContact CB-CE2 4.33Å; P547-Y549 HydrophobicContact CG-CD2 4.25Å; P547-Y549 HydrophobicContact CG-CE2 3.85Å; P547-Y549 WeakPolarHBondContact O-CD2 3.45Å; P547-Y549 PolarHBondContact O-N 3.44Å
548	V	31.6	Very low	27.6	Very low	135 Å²	135	140.2 Å²	140.2	82%	0.818	77%	0.767	S	S	*	*			trans	-58	95.4	168.9	178.9	0	0	0	0	106.3	E546 D550	E546-V548 PolarHBondContact O-N 2.88Å; V548-D550 PolarHBondContact O-N 2.8Å; V548-D550 VanDerWaalsContact O-N 3.14Å
549	Y	30.1	Very low	27.8	Very low	197 Å²	197	139.4 Å²	139.4	77%	0.773	77%	0.766	S	S	*	*			trans	-70.5	108.3	169.1	-87.1	-87.2	0	0	0	106.3	P547 S551	P547-Y549 VanDerWaalsContact C-N 3.25Å; P547-Y549 HydrophobicContact CB-CD2 4.49Å; P547-Y549 HydrophobicContact CB-CE2 4.33Å; P547-Y549 HydrophobicContact CG-CD2 4.25Å; P547-Y549 HydrophobicContact CG-CE2 3.85Å; P547-Y549 WeakPolarHBondContact O-CD2 3.45Å; P547-Y549 PolarHBondContact O-N 3.44Å; Y549-S551 PolarHBondContact O-N 3.28Å
550	D	28.3	Very low	27.9	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	76%	0.764	S	S	*	*			trans	-47.8	112.5	167.6	-89.1	-31.1	0	0	0	108	V548 C552	V548-D550 PolarHBondContact O-N 2.8Å; V548-D550 VanDerWaalsContact O-N 3.14Å; D550-C552 PolarHBondContact O-N 3.05Å
551	S	27.6	Very low	28.1	Very low	119 Å²	119	141.7 Å²	141.7	83%	0.832	76%	0.761	S	S	*	*			trans	-64.2	97.9	-179.1	-49	0	0	0	0	107.6	Y549 G553	Y549-S551 PolarHBondContact O-N 3.28Å; S551-G553 PolarHBondContact O-N 3.39Å; S551-G553 VanDerWaalsContact O-N 3.08Å
552	C	28.3	Very low	28.3	Very low	128 Å²	128	141 Å²	141	87%	0.865	76%	0.761	S	S	*	*			trans	-65.3	110.8	167.8	43.9	0	0	0	0	107.7	D550	D550-C552 PolarHBondContact O-N 3.05Å
553	G	27.9	Very low	28.5	Very low	69 Å²	69	140.4 Å²	140.4	71%	0.711	76%	0.758	S	S	*	*			trans	-57	139	-172.3	0	0	0	0	0	113.8	S551	S551-G553 PolarHBondContact O-N 3.39Å; S551-G553 VanDerWaalsContact O-N 3.08Å
554	N	26.7	Very low	28.7	Very low	120 Å²	120	138.8 Å²	138.8	64%	0.642	76%	0.759	S	S	*	*			trans	55.7	97.1	133.3	-157.6	0.8	0	0	0	117.7	D556	N554-D556 VanDerWaalsContact OD1-CG 3.25Å; N554-D556 PolarHBondContact OD1-N 3.28Å; N554-D556 VanDerWaalsContact OD1-N 3.15Å; N554-D556 PolarHBondContact OD1-OD1 3.03Å; N554-D556 PolarHBondContact OD1-OD2 3.2Å
555	R	28.7	Very low	28.8	Very low	240 Å²	240	140.9 Å²	140.9	91%	0.906	76%	0.761	S	S	*	*			trans	-132.2	96.7	133.2	-86.1	-166.1	175.3	179.2	-1.2	109.9	N557	R555-N557 PolarHBondContact O-N 3.41Å
556	D	29.8	Very low	28.6	Very low	127 Å²	127	144.7 Å²	144.7	68%	0.679	77%	0.768	S	S	*	*			trans	-44.9	112.2	155.6	-60.7	-43.8	0	0	0	110.5	N554	N554-D556 VanDerWaalsContact OD1-CG 3.25Å; N554-D556 PolarHBondContact OD1-N 3.28Å; N554-D556 VanDerWaalsContact OD1-N 3.15Å; N554-D556 PolarHBondContact OD1-OD1 3.03Å; N554-D556 PolarHBondContact OD1-OD2 3.2Å
557	N	32	Very low	28.7	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	77%	0.771	S	S	*	*			trans	-136.7	102.4	150.9	-83.1	-35.8	0	0	0	107	R555	R555-N557 PolarHBondContact O-N 3.41Å
558	N	27.5	Very low	28.7	Very low	151 Å²	151	143.1 Å²	143.1	81%	0.807	77%	0.773	S	S	*	*			trans	-49.8	159.1	172.1	-91.4	-10.2	0	0	0	113.6
559	S	30.2	Very low	28.5	Very low	101 Å²	101	144.5 Å²	144.5	71%	0.706	78%	0.775	S	S	*	*			trans	93.5	120.4	145.4	54.5	0	0	0	0	120.1
560	Q	28.3	Very low	28.3	Very low	163 Å²	163	143.1 Å²	143.1	76%	0.762	78%	0.776	S	S	*	*			trans	67.3	129.3	147.6	-98.3	50.1	26.1	0	0	117
561	D	29.2	Very low	28.2	Very low	127 Å²	127	141.1 Å²	141.1	68%	0.679	77%	0.774	S	S	*	*			cis	-153.6	137.6	28.7	-106.5	-41.6	0	0	0	109.9
562	I	26.7	Very low	28	Very low	150 Å²	150	142.8 Å²	142.8	77%	0.769	78%	0.779	S	S	*	*			trans	-86.6	114.6	164.2	-64.6	168.1	0	0	0	105.8	E564	I562-E564 HydrophobicContact CG2-CG 4.19Å
563	I	31.1	Very low	27.9	Very low	132 Å²	132	142 Å²	142	68%	0.677	77%	0.774	S	S	*	*			trans	-119.6	92.3	162.6	-57.3	178.6	0	0	0	106.4	L565	I563-L565 HydrophobicContact CG2-CD1 3.92Å; I563-L565 HydrophobicContact CG2-CG 4.36Å; I563-L565 PolarHBondContact O-N 3.2Å
564	E	26.8	Very low	27.9	Very low	176 Å²	176	143.4 Å²	143.4	82%	0.822	78%	0.779	S	S	*	*			trans	-61.6	119.5	159.2	-77.5	173.9	145.5	0	0	108.1	I562	I562-E564 HydrophobicContact CG2-CG 4.19Å
565	L	28.6	Very low	27.7	Very low	160 Å²	160	144.4 Å²	144.4	84%	0.838	79%	0.789	S	S	*	*			trans	-109.4	86.6	165	-96.8	137.3	0	0	0	107.3	I563 C567	I563-L565 HydrophobicContact CG2-CD1 3.92Å; I563-L565 HydrophobicContact CG2-CG 4.36Å; I563-L565 PolarHBondContact O-N 3.2Å; L565-C567 PolarHBondContact O-N 3.36Å
566	E	25.4	Very low	27.7	Very low	175 Å²	175	140.1 Å²	140.1	82%	0.818	78%	0.784	S	S	*	*			trans	-64.7	111.7	165.9	-168.5	177.4	-165.4	0	0	108.2
567	C	26.7	Very low	27.4	Very low	129 Å²	129	137 Å²	137	87%	0.872	78%	0.782	S	S	*	*			trans	-106.3	103.1	174.8	-142.7	0	0	0	0	107.9	L565	L565-C567 PolarHBondContact O-N 3.36Å
568	T	31.1	Very low	27.1	Very low	101 Å²	101	138 Å²	138	62%	0.62	78%	0.781	S	S	*	*			trans	-81.8	122.8	-172.8	-34.1	0	0	0	0	111	Q570	T568-Q570 PolarHBondContact O-N 3.09Å
569	D	26.7	Very low	27	Very low	163 Å²	163	141.2 Å²	141.2	87%	0.872	78%	0.784	S	S	*	*			trans	-69.6	100.8	170.6	-70.7	-44.3	0	0	0	111.3
570	Q	27.7	Very low	27	Very low	168 Å²	168	145 Å²	145	79%	0.785	79%	0.79	S	S	*	*			trans	-149.9	113.1	164.2	-68.9	-171.4	15.4	0	0	112	T568	T568-Q570 PolarHBondContact O-N 3.09Å
571	S	26.3	Very low	26.9	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	79%	0.787	S	S	*	*				163.6	109.4	112.7	61	0	0	0	0	111.7
572	T	23.1	Very low	26.9	Very low	154 Å²	154	147.2 Å²	147.2	95%	0.945	79%	0.793	S	S	*	*			trans	-86.7	113.2	161.5	-42.2	0	0	0	0	106.4
573	C	26.1	Very low	26.9	Very low	112 Å²	112	146.4 Å²	146.4	76%	0.757	79%	0.791	S	S	*	*			trans	-126.7	139.6	175.4	-56.4	0	0	0	0	111.1
574	A	26.7	Very low	26.9	Very low	98 Å²	98	145.2 Å²	145.2	81%	0.81	79%	0.794	S	S	*	*			trans	-71.2	154	-158.9	0	0	0	0	0	116.6	N576	A574-N576 PolarHBondContact O-N 2.96Å
575	V	23.6	Very low	26.9	Very low	141 Å²	141	143 Å²	143	86%	0.855	79%	0.792	S	S	*	*			trans	-49.8	120.9	160.4	174.4	0	0	0	0	110.3
576	N	29.2	Very low	27	Very low	150 Å²	150	142.5 Å²	142.5	80%	0.802	79%	0.79	S	S	*	*			trans	-117.6	107.7	168.2	-139.9	30.1	0	0	0	108.1	A574	A574-N576 PolarHBondContact O-N 2.96Å
577	G	22.1	Very low	27.2	Very low	61 Å²	61	138.8 Å²	138.8	63%	0.629	78%	0.782	S	S	*	*			trans	-80.8	127.3	172.8	0	0	0	0	0	110.2
578	H	26.4	Very low	27.3	Very low	178 Å²	178	141.5 Å²	141.5	82%	0.824	79%	0.786	S	S	*	*			trans	-142.3	111.2	157.4	-99.9	-73.2	0	0	0	108.9
579	Y	25.1	Very low	27.1	Very low	219 Å²	219	141.5 Å²	141.5	86%	0.859	79%	0.79	S	S	*	*			trans	-68.1	126.5	163.3	-88.5	-104	0	0	0	108.8
580	E	30.8	Very low	27.2	Very low	179 Å²	179	142.6 Å²	142.6	84%	0.836	79%	0.79	S	S	*	*			trans	-145.9	125.9	142.5	-74.1	-158.8	159.3	0	0	110.3
581	H	25.2	Very low	27.2	Very low	151 Å²	151	145.3 Å²	145.3	70%	0.699	79%	0.793	S	S	*	*			trans	-78.1	124.4	-179.8	-131.1	-70.8	0	0	0	108.8	D583	H581-D583 IonicContact CE1-OD2 2.87Å; H581-D583 PolarHBondContact CE1-OD2 3.46Å; H581-D583 IonicContact ND1-OD2 3.1Å; H581-D583 PolarHBondContact ND1-OD2 3.25Å
582	F	30.5	Very low	27.3	Very low	187 Å²	187	148.6 Å²	148.6	82%	0.82	80%	0.797	S	S	*	*			trans	-133.7	97.7	158.1	-94.2	-81.6	0	0	0	109.2	S584	F582-S584 PolarHBondContact O-N 3.39Å
583	D	26.8	Very low	27.6	Very low	133 Å²	133	147.5 Å²	147.5	71%	0.711	79%	0.785	S	S	*	*			trans	-71.1	104.8	162.1	-69.6	-57.1	0	0	0	108.2	H581	H581-D583 IonicContact CE1-OD2 2.87Å; H581-D583 PolarHBondContact CE1-OD2 3.46Å; H581-D583 IonicContact ND1-OD2 3.1Å; H581-D583 PolarHBondContact ND1-OD2 3.25Å
584	S	29.6	Very low	27.6	Very low	107 Å²	107	153.1 Å²	153.1	75%	0.748	79%	0.79	S	S	*	*			trans	-126.6	90.3	164.8	-177.2	0	0	0	0	108.2	F582 D586	F582-S584 PolarHBondContact O-N 3.39Å; S584-D586 PolarHBondContact O-N 3.28Å
585	V	28.3	Very low	27.9	Very low	129 Å²	129	154.6 Å²	154.6	78%	0.782	79%	0.789	S	S	*	*			trans	-71.6	106.9	168.5	-178.4	0	0	0	0	107.3
586	D	30	Very low	28.2	Very low	150 Å²	150	155.6 Å²	155.6	80%	0.802	78%	0.784	S	S	*	*			trans	-125.5	104	159	-145.5	-3.7	0	0	0	108.1	S584 L588	S584-D586 PolarHBondContact O-N 3.28Å; D586-L588 PolarHBondContact O-N 3.24Å
587	P	29.9	Very low	28.2	Very low	97 Å²	97	153.9 Å²	153.9	63%	0.63	78%	0.784	S	S	*	*			trans	-79.3	117.1	-176.1	29.1	-28	0	0	0	110.4	S589	P587-S589 PolarHBondContact O-N 2.95Å; P587-S589 VanDerWaalsContact O-N 3.09Å
588	L	28	Very low	28.7	Very low	185 Å²	185	157.6 Å²	157.6	97%	0.969	79%	0.79	S	S	*	*			trans	-2.3	96	151.3	-65.2	168.4	0	0	0	115.1	D586	D586-L588 PolarHBondContact O-N 3.24Å
589	S	28.2	Very low	28.9	Very low	101 Å²	101	158.9 Å²	158.9	71%	0.706	79%	0.793	S	S	*	*			trans	-120.5	103.4	160.2	-179.3	0	0	0	0	109.2	P587 R591	P587-S589 PolarHBondContact O-N 2.95Å; P587-S589 VanDerWaalsContact O-N 3.09Å; S589-R591 PolarHBondContact O-N 3.36Å
590	Q	28.1	Very low	29.3	Very low	186 Å²	186	154.7 Å²	154.7	87%	0.869	78%	0.784	S	S	*	*			trans	35.8	85.9	141.5	-80.8	171.5	-4.9	0	0	116.3
591	R	27.5	Very low	29.1	Very low	225 Å²	225	155 Å²	155	85%	0.849	79%	0.785	S	S	*	*			trans	-114.6	88.4	146.8	-145.5	172.7	-173.5	174.6	1.5	109.3	S589 N593	S589-R591 PolarHBondContact O-N 3.36Å; R591-N593 VanDerWaalsContact C-N 3.26Å; R591-N593 PolarHBondContact O-N 3.4Å
592	E	27.9	Very low	29.4	Very low	178 Å²	178	156 Å²	156	83%	0.832	79%	0.788	S	S	*	*			trans	-47.6	81.9	164.4	-169.9	-179.4	-172.3	0	0	110.9	R594	E592-R594 PolarHBondContact O-N 3.11Å
593	N	30.1	Very low	29.5	Very low	130 Å²	130	152.7 Å²	152.7	70%	0.695	79%	0.785	S	S	*	*			trans	-86.4	94.6	166.1	-79.3	-29.4	0	0	0	108	R591 V595	R591-N593 VanDerWaalsContact C-N 3.26Å; R591-N593 PolarHBondContact O-N 3.4Å; N593-V595 PolarHBondContact O-N 3.46Å
594	R	26.8	Very low	29.6	Very low	231 Å²	231	154.1 Å²	154.1	87%	0.872	79%	0.793	S	S	*	*			trans	-40.5	101.9	156.1	-86.6	174.2	164.4	171.3	-4.9	109.9	E592	E592-R594 PolarHBondContact O-N 3.11Å
595	V	31.9	Very low	29.7	Very low	129 Å²	129	154.3 Å²	154.3	78%	0.782	79%	0.794	S	S	*	*			trans	-114.1	107.1	158	-177.6	0	0	0	0	106.3	N593 S597	N593-V595 PolarHBondContact O-N 3.46Å; V595-S597 PolarHBondContact O-N 3.14Å
596	Q	29.1	Very low	29.9	Very low	161 Å²	161	153.1 Å²	153.1	75%	0.752	79%	0.791	S	S	*	*			trans	-47	121.3	178.4	-158.8	102.7	-7.6	0	0	110.2	D598	Q596-D598 VanDerWaalsContact C-N 3.35Å; Q596-D598 PolarHBondContact O-N 3.06Å
597	S	29.7	Very low	30	Very low	115 Å²	115	150.3 Å²	150.3	80%	0.804	79%	0.789	S	S	*	*			trans	-70.3	89.1	172.5	-55.3	0	0	0	0	110	V595 K599	V595-S597 PolarHBondContact O-N 3.14Å; S597-K599 PolarHBondContact O-N 3.23Å
598	D	32.6	Very low	30.3	Very low	138 Å²	138	151.4 Å²	151.4	74%	0.738	79%	0.794	S	S	*	*			trans	-71.1	111.8	161.9	-78.9	-22.2	0	0	0	108.2	Q596 I600	Q596-D598 VanDerWaalsContact C-N 3.35Å; Q596-D598 PolarHBondContact O-N 3.06Å; D598-I600 PolarHBondContact O-N 3.43Å
599	K	31.2	Very low	30.7	Very low	205 Å²	205	147.8 Å²	147.8	89%	0.891	78%	0.782	S	S	*	*			trans	-63.5	91.7	176.4	-67.1	177.6	177.2	-174.7	0	109.2	S597 E601	S597-K599 PolarHBondContact O-N 3.23Å; K599-E601 PolarHBondContact O-N 3.34Å
600	I	33.5	Very low	31.3	Very low	131 Å²	131	151.3 Å²	151.3	67%	0.672	79%	0.792	S	S	*	*			trans	-83.4	99.7	160.4	-61.7	172.3	0	0	0	105.8	D598 F602	D598-I600 PolarHBondContact O-N 3.43Å; I600-F602 HydrophobicContact CB-CE2 4.49Å; I600-F602 HydrophobicContact CG2-CD2 4.47Å; I600-F602 HydrophobicContact CG2-CE2 4.16Å; I600-F602 HydrophobicContact CG2-CZ 4.35Å; I600-F602 WeakPolarHBondContact O-CD2 3.21Å; I600-F602 PolarHBondContact O-N 3.39Å
601	E	26.7	Very low	31.9	Very low	186 Å²	186	152.7 Å²	152.7	87%	0.869	79%	0.791	S	S	*	*			trans	-63.8	97.2	173.1	-166.5	168.7	-154.2	0	0	108	K599	K599-E601 PolarHBondContact O-N 3.34Å
602	F	31.8	Very low	32.3	Very low	172 Å²	172	146 Å²	146	75%	0.754	78%	0.784	S	S	*	*			trans	-73.5	124.5	169.4	-75.4	-85.4	0	0	0	107.9	I600 D604	I600-F602 HydrophobicContact CB-CE2 4.49Å; I600-F602 HydrophobicContact CG2-CD2 4.47Å; I600-F602 HydrophobicContact CG2-CE2 4.16Å; I600-F602 HydrophobicContact CG2-CZ 4.35Å; I600-F602 WeakPolarHBondContact O-CD2 3.21Å; I600-F602 PolarHBondContact O-N 3.39Å; F602-D604 PolarHBondContact O-N 3.32Å
603	P	31.7	Very low	32.8	Very low	118 Å²	118	141.1 Å²	141.1	77%	0.766	77%	0.767	S	S	*	*			trans	-63.5	128.6	174.5	24.8	-31.1	0	0	0	108.9	S605	P603-S605 PolarHBondContact O-N 2.91Å
604	D	30.2	Very low	34	Very low	163 Å²	163	139.1 Å²	139.1	87%	0.872	76%	0.757	S	S	*	*			trans	-44	106.4	176.2	-69.3	-44.9	0	0	0	110.3	F602 S606	F602-D604 PolarHBondContact O-N 3.32Å; D604-S606 VanDerWaalsContact C-N 3.32Å; D604-S606 PolarHBondContact O-N 2.93Å
605	S	30	Very low	35.3	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	75%	0.748	S	S	*	*			trans	-58	103.9	164.7	175	0	0	0	0	106	P603 A607	P603-S605 PolarHBondContact O-N 2.91Å; S605-A607 PolarHBondContact O-N 3.09Å
606	S	32.8	Very low	36.3	Very low	103 Å²	103	129.4 Å²	129.4	72%	0.72	73%	0.731	S	S	*	*			trans	-50.3	110.8	168.6	44.6	0	0	0	0	107.1	D604 T608	D604-S606 VanDerWaalsContact C-N 3.32Å; D604-S606 PolarHBondContact O-N 2.93Å; S606-T608 PolarHBondContact O-N 3.14Å
607	A	33.3	Very low	37.8	Very low	92 Å²	92	124.5 Å²	124.5	76%	0.76	71%	0.712	S	S	*	*			trans	-46.6	109.5	175.7	0	0	0	0	0	107.5	S605 P609	S605-A607 PolarHBondContact O-N 3.09Å; A607-P609 VanDerWaalsContact O-N 3.13Å
608	T	35.9	Very low	38.9	Very low	119 Å²	119	121 Å²	121	73%	0.73	69%	0.689	S	S	*	*			trans	-52.8	124.1	173.4	-37.9	0	0	0	0	105.3	S606 L610	S606-T608 PolarHBondContact O-N 3.14Å; T608-L610 PolarHBondContact O-N 3.06Å
609	P	35.3	Very low	39.9	Very low	110 Å²	110	121.2 Å²	121.2	71%	0.714	68%	0.681	S	S	*	*			trans	-52.1	115.8	-176.8	-22.1	29.8	0	0	0	107	A607 Y611	A607-P609 VanDerWaalsContact O-N 3.13Å; P609-Y611 VanDerWaalsContact C-N 3.28Å; P609-Y611 PolarHBondContact O-N 3.39Å
610	L	41.1	Very low	40.9	Very low	175 Å²	175	116.5 Å²	116.5	92%	0.916	67%	0.665	S	S	*	*			trans	-53.5	105.2	172.5	-92.9	168.4	0	0	0	105.2	T608 A612	T608-L610 PolarHBondContact O-N 3.06Å; L610-A612 VanDerWaalsContact C-N 3.3Å; L610-A612 PolarHBondContact O-N 3.5Å
611	Y	40.7	Very low	42	Very low	214 Å²	214	118.6 Å²	118.6	84%	0.839	66%	0.664	S	S	*	*			trans	-59.1	99.6	-176.3	-139.5	-96.1	0	0	0	105.2	P609 P613	P609-Y611 VanDerWaalsContact C-N 3.28Å; P609-Y611 PolarHBondContact O-N 3.39Å; Y611-P613 WeakPolarHBondContact O-CD 3.4Å
612	A	37	Very low	43.2	Very low	86 Å²	86	119.3 Å²	119.3	71%	0.711	66%	0.659	S	S	*	*			trans	-56.7	113.8	170.6	0	0	0	0	0	104.7	L610 D614	L610-A612 VanDerWaalsContact C-N 3.3Å; L610-A612 PolarHBondContact O-N 3.5Å; A612-D614 PolarHBondContact O-N 3.05Å
613	P	38	Very low	44.2	Very low	74 Å²	74	115.8 Å²	115.8	48%	0.481	65%	0.645	S	S	.	*			trans	-60.1	130.5	-172.9	20.6	-29.5	0	0	0	108.2	Y611	Y611-P613 WeakPolarHBondContact O-CD 3.4Å
614	D	55.3	Low	44.9	Very low	89 Å²	89	115.3 Å²	115.3	48%	0.476	64%	0.636	S	S	.	*			trans	-41.3	130.1	167.4	168.1	-1	0	0	0	108.9	A612 A616 T617 A618	A612-D614 PolarHBondContact O-N 3.05Å; D614-A616 PolarHBondContact O-N 2.97Å; D614-A616 WeakPolarHBondContact OD1-CB 3.13Å; D614-A616 PolarHBondContact OD1-N 2.73Å; D614-T617 WeakPolarHBondContact O-CA 3.28Å; D614-T617 WeakPolarHBondContact O-CB 3.1Å; D614-T617 PolarHBondContact O-N 2.94Å; D614-A618 PolarHBondContact O-N 3.43Å
615	P	54.5	Low	45.8	Very low	106 Å²	106	115.4 Å²	115.4	69%	0.688	63%	0.633	S	S	*	*	H	α-helix	trans	-43.5	-33.9	174.9	-29.4	33.4	0	0	0	114.3	A618 Y619	P615-A618 PolarHBondContact O-N 3.42Å; P615-Y619 WeakPolarHBondContact O-CB 3.39Å; P615-Y619 PolarHBondContact O-N 2.98Å
616	A	51	Low	46.3	Very low	50 Å²	50	112.8 Å²	112.8	41%	0.413	62%	0.624	S	S	.	*	H	α-helix	trans	-64.2	-39.4	175.8	0	0	0	0	0	112.7	D614 Y619 L620	D614-A616 PolarHBondContact O-N 2.97Å; D614-A616 WeakPolarHBondContact OD1-CB 3.13Å; D614-A616 PolarHBondContact OD1-N 2.73Å; A616-Y619 PolarHBondContact O-N 3.49Å; A616-L620 WeakPolarHBondContact O-CG 3.49Å; A616-L620 PolarHBondContact O-N 2.88Å
617	T	61.1	Low	46.4	Very low	58 Å²	58	112.4 Å²	112.4	36%	0.356	61%	0.612	S	S	.	*	H	α-helix	trans	-69.4	-39.8	176.7	-55.2	0	0	0	0	111	D614 Y619 L620 R621	D614-T617 WeakPolarHBondContact O-CA 3.28Å; D614-T617 WeakPolarHBondContact O-CB 3.1Å; D614-T617 PolarHBondContact O-N 2.94Å; T617-Y619 VanDerWaalsContact C-N 3.32Å; T617-Y619 PolarHBondContact O-N 2.82Å; T617-L620 PolarHBondContact O-N 3.34Å; T617-R621 WeakPolarHBondContact O-CG 3.43Å; T617-R621 PolarHBondContact O-N 3.16Å
618	A	52.8	Low	46.6	Very low	40 Å²	40	111.9 Å²	111.9	33%	0.331	60%	0.603	S	S	.	*	H	α-helix	trans	-63.7	-38.9	174.9	0	0	0	0	0	111.7	D614 P615 R621 R622	D614-A618 PolarHBondContact O-N 3.43Å; P615-A618 PolarHBondContact O-N 3.42Å; A618-R621 PolarHBondContact O-N 3.42Å; A618-R622 WeakPolarHBondContact O-CG 3.4Å; A618-R622 PolarHBondContact O-N 3.34Å; A618-R622 VanDerWaalsContact O-N 3.13Å
619	Y	53.1	Low	46.5	Very low	144 Å²	144	112.6 Å²	112.6	57%	0.565	60%	0.603	S	S	*	*	H	α-helix	trans	-64.6	-45.6	175.1	-175	-97.1	0	0	0	112.2	P615 A616 T617 R621 R622 Q623	P615-Y619 WeakPolarHBondContact O-CB 3.39Å; P615-Y619 PolarHBondContact O-N 2.98Å; A616-Y619 PolarHBondContact O-N 3.49Å; T617-Y619 VanDerWaalsContact C-N 3.32Å; T617-Y619 PolarHBondContact O-N 2.82Å; Y619-R621 VanDerWaalsContact C-N 3.33Å; Y619-R621 PolarHBondContact O-N 3.5Å; Y619-R622 PolarHBondContact O-N 3.38Å; Y619-R622 VanDerWaalsContact O-N 3.14Å; Y619-Q623 HydrophobicContact CD1-CG 4.22Å; Y619-Q623 HydrophobicContact CE1-CG 3.84Å; Y619-Q623 PolarHBondContact O-N 3.47Å; Y619-Q623 PolarHBondContact OH-NE2 3.26Å
620	L	53.9	Low	46.3	Very low	106 Å²	106	116 Å²	116	56%	0.555	60%	0.602	S	S	*	*	H	α-helix	trans	-60.6	-39.4	176.2	-77.3	165.7	0	0	0	112.6	A616 T617 R622 Q623 N624	A616-L620 WeakPolarHBondContact O-CG 3.49Å; A616-L620 PolarHBondContact O-N 2.88Å; T617-L620 PolarHBondContact O-N 3.34Å; L620-R622 PolarHBondContact O-N 3.19Å; L620-Q623 PolarHBondContact O-N 3.48Å; L620-N624 PolarHBondContact O-N 3.5Å
621	R	54.9	Low	46.1	Very low	174 Å²	174	112.2 Å²	112.2	66%	0.657	59%	0.587	S	S	*	*	H	α-helix	trans	-64.6	-38	174.6	-72.5	-175.7	-172.7	-174.1	3.3	112.6	T617 A618 Y619 N624 M625	T617-R621 WeakPolarHBondContact O-CG 3.43Å; T617-R621 PolarHBondContact O-N 3.16Å; A618-R621 PolarHBondContact O-N 3.42Å; Y619-R621 VanDerWaalsContact C-N 3.33Å; Y619-R621 PolarHBondContact O-N 3.5Å; R621-N624 PolarHBondContact O-N 3.11Å; R621-M625 PolarHBondContact O-N 3.07Å
622	R	53.5	Low	45.7	Very low	201 Å²	201	107.7 Å²	107.7	76%	0.758	58%	0.577	S	S	*	*	H	α-helix	trans	-66.2	-37.2	175.7	-72.3	-178.9	-177.7	-152.7	1.4	112.1	A618 Y619 L620	A618-R622 WeakPolarHBondContact O-CG 3.4Å; A618-R622 PolarHBondContact O-N 3.34Å; A618-R622 VanDerWaalsContact O-N 3.13Å; Y619-R622 PolarHBondContact O-N 3.38Å; Y619-R622 VanDerWaalsContact O-N 3.14Å; L620-R622 PolarHBondContact O-N 3.19Å
623	Q	51.2	Low	45.4	Very low	99 Å²	99	111.6 Å²	111.6	46%	0.463	58%	0.578	S	S	.	*	H	α-helix	trans	-68.6	-39.9	175.9	-68.2	-63.8	-24.6	0	0	112	Y619 L620 M625 G626	Y619-Q623 HydrophobicContact CD1-CG 4.22Å; Y619-Q623 HydrophobicContact CE1-CG 3.84Å; Y619-Q623 PolarHBondContact O-N 3.47Å; Y619-Q623 PolarHBondContact OH-NE2 3.26Å; L620-Q623 PolarHBondContact O-N 3.48Å; Q623-M625 VanDerWaalsContact C-N 3.27Å; Q623-M625 PolarHBondContact O-N 3.31Å; Q623-G626 PolarHBondContact O-N 3.3Å
624	N	48.2	Very low	45.2	Very low	108 Å²	108	114 Å²	114	58%	0.578	59%	0.586	S	S	*	*	H	α-helix	trans	-71.6	-16.2	179.6	-75.7	-11	0	0	0	114.3	L620 R621 G626 I627	L620-N624 PolarHBondContact O-N 3.5Å; R621-N624 PolarHBondContact O-N 3.11Å; N624-G626 PolarHBondContact O-N 3.26Å; N624-I627 PolarHBondContact O-N 3.4Å
625	M	48	Very low	44.1	Very low	165 Å²	165	112.7 Å²	112.7	81%	0.813	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-14.2	172.7	-81.3	-176	150.9	0	0	113.5	R621 Q623	R621-M625 PolarHBondContact O-N 3.07Å; Q623-M625 VanDerWaalsContact C-N 3.27Å; Q623-M625 PolarHBondContact O-N 3.31Å
626	G	40.9	Very low	43	Very low	56 Å²	56	113.9 Å²	113.9	58%	0.577	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-16.8	176.1	0	0	0	0	0	115.3	Q623 N624	Q623-G626 PolarHBondContact O-N 3.3Å; N624-G626 PolarHBondContact O-N 3.26Å
627	I	35.1	Very low	42.2	Very low	94 Å²	94	116.4 Å²	116.4	48%	0.482	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.9	-16.2	-165.4	-52.3	171.4	0	0	0	112.3	N624 N629 Y630	N624-I627 PolarHBondContact O-N 3.4Å; I627-N629 PolarHBondContact O-N 3.26Å; I627-N629 VanDerWaalsContact O-N 3.13Å; I627-Y630 PolarHBondContact O-N 3.01Å
628	S	36.6	Very low	40.9	Very low	81 Å²	81	118.6 Å²	118.6	57%	0.566	61%	0.607	S	S	*	*	H	α-helix	trans	-64.3	-19.8	179.8	65.1	0	0	0	0	114
629	N	34	Very low	39.9	Very low	135 Å²	135	124.9 Å²	124.9	72%	0.722	63%	0.629	S	S	*	*	H	α-helix	trans	-81.6	-12.3	174	-82.5	-21.4	0	0	0	114.5	I627	I627-N629 PolarHBondContact O-N 3.26Å; I627-N629 VanDerWaalsContact O-N 3.13Å
630	Y	31.5	Very low	38.9	Very low	180 Å²	180	125.6 Å²	125.6	71%	0.706	64%	0.642	S	S	*	*	H	α-helix	trans	-89.3	-28.2	178	-109	-86.6	0	0	0	113.2	I627 K633	I627-Y630 PolarHBondContact O-N 3.01Å; Y630-K633 PolarHBondContact O-N 3.17Å
631	V	36.7	Very low	37.8	Very low	97 Å²	97	129.1 Å²	129.1	59%	0.588	66%	0.656	S	S	*	*	H	α-helix	trans	-73.8	-31.3	-178.7	-168.3	0	0	0	0	111.7	K633 L634 S635	V631-K633 VanDerWaalsContact C-N 3.26Å; V631-K633 PolarHBondContact O-N 3.26Å; V631-L634 PolarHBondContact O-N 3.29Å; V631-L634 VanDerWaalsContact O-N 3.17Å; V631-S635 PolarHBondContact O-N 3.42Å
632	N	31.6	Very low	36.6	Very low	118 Å²	118	129.6 Å²	129.6	63%	0.631	67%	0.665	S	S	*	*	H	α-helix	trans	-72.5	-13.6	177.4	-106.5	-1	0	0	0	114.6
633	K	32	Very low	35.4	Very low	169 Å²	169	127.7 Å²	127.7	74%	0.735	67%	0.669	S	S	*	*	H	α-helix	trans	-87.7	-16.9	170.8	-83.6	-167.3	174.1	-168.4	0	113.4	Y630 V631	Y630-K633 PolarHBondContact O-N 3.17Å; V631-K633 VanDerWaalsContact C-N 3.26Å; V631-K633 PolarHBondContact O-N 3.26Å
634	L	32.3	Very low	34.4	Very low	124 Å²	124	128.7 Å²	128.7	65%	0.649	69%	0.686	S	S	*	*	H	α-helix	trans	-89.1	-22.2	176.8	-81.4	157.4	0	0	0	112.9	V631 I636	V631-L634 PolarHBondContact O-N 3.29Å; V631-L634 VanDerWaalsContact O-N 3.17Å; L634-I636 VanDerWaalsContact C-N 3.34Å; L634-I636 PolarHBondContact O-N 2.95Å
635	S	33.4	Very low	33.5	Very low	62 Å²	62	131.4 Å²	131.4	43%	0.434	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.2	-22	177.1	73.9	0	0	0	0	114	V631 V637 T638	V631-S635 PolarHBondContact O-N 3.42Å; S635-V637 VanDerWaalsContact C-N 3.34Å; S635-T638 PolarHBondContact O-OG1 2.78Å
636	I	31.6	Very low	32.5	Very low	130 Å²	130	132 Å²	132	67%	0.667	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-18.1	-179.9	-56.2	176.9	0	0	0	111.8	L634	L634-I636 VanDerWaalsContact C-N 3.34Å; L634-I636 PolarHBondContact O-N 2.95Å
637	V	33.6	Very low	32	Very low	103 Å²	103	134.2 Å²	134.2	62%	0.624	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-22.3	-179.2	-175.4	0	0	0	0	112.2	S635	S635-V637 VanDerWaalsContact C-N 3.34Å
638	T	33.4	Very low	31.7	Very low	105 Å²	105	134.8 Å²	134.8	64%	0.644	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-10.2	-179.8	35.3	0	0	0	0	115.3	S635	S635-T638 PolarHBondContact O-OG1 2.78Å
639	E	32.5	Very low	31.5	Very low	172 Å²	172	138.3 Å²	138.3	80%	0.804	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-4.8	179.5	-71.1	-166.5	171.6	0	0	114.6
640	L	32	Very low	31.2	Very low	158 Å²	158	135.9 Å²	135.9	83%	0.827	74%	0.742	S	S	*	*	S	Bend	trans	-99.7	-7.9	-177.3	-142	80.6	0	0	0	115.6
641	E	31.2	Very low	31	Very low	181 Å²	181	133.4 Å²	133.4	85%	0.846	75%	0.748	S	S	*	*	S	Bend	trans	-108.5	2.4	-177.9	-77.6	-174	159.1	0	0	114.9	L643	E641-L643 VanDerWaalsContact C-N 3.3Å; E641-L643 PolarHBondContact O-N 3.19Å
642	Q	29.5	Very low	30.7	Very low	183 Å²	183	136.3 Å²	136.3	86%	0.855	76%	0.759	S	S	*	*	S	Bend	trans	-88.4	14.9	-179.3	-119.9	175	14.5	0	0	115.2
643	L	29.1	Very low	30.6	Very low	161 Å²	161	140 Å²	140	84%	0.843	77%	0.77	S	S	*	*	S	Bend	trans	-128.1	49.3	-171.8	-114.5	155.5	0	0	0	112	E641	E641-L643 VanDerWaalsContact C-N 3.3Å; E641-L643 PolarHBondContact O-N 3.19Å
644	C	28.7	Very low	30.2	Very low	120 Å²	120	137.1 Å²	137.1	81%	0.811	78%	0.777	S	S	*	*	S	Bend	trans	-165.3	58.5	169	-110.5	0	0	0	0	112.5
645	D	29	Very low	29.9	Very low	165 Å²	165	135.9 Å²	135.9	88%	0.882	78%	0.779	S	S	*	*			trans	-153	50.5	166.3	-89.7	-35	0	0	0	111.7
646	D	28	Very low	29.8	Very low	178 Å²	178	140 Å²	140	95%	0.952	80%	0.796	S	S	*	*			trans	-117.4	76.8	165.1	-90	-27.4	0	0	0	109.4
647	S	30.1	Very low	29.6	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	81%	0.806	S	S	*	*			trans	-141.2	78.4	163.2	170.5	0	0	0	0	109.8	I649	S647-I649 PolarHBondContact O-N 3.12Å
648	A	28.8	Very low	29.6	Very low	106 Å²	106	142.4 Å²	142.4	88%	0.876	82%	0.818	S	S	*	*			trans	-61.3	109.2	160.2	0	0	0	0	0	110.3
649	I	33.1	Very low	29.2	Very low	154 Å²	154	143.2 Å²	143.2	79%	0.79	82%	0.823	S	S	*	*			trans	-134.2	123.6	155.6	-58.8	-176.8	0	0	0	108.8	S647	S647-I649 PolarHBondContact O-N 3.12Å
650	A	27.7	Very low	28.9	Very low	84 Å²	84	143.1 Å²	143.1	69%	0.694	83%	0.827	S	S	*	*			trans	-67.9	163.8	-168.4	0	0	0	0	0	115.1
651	P	27.3	Very low	28.9	Very low	128 Å²	128	140.9 Å²	140.9	83%	0.831	82%	0.822	S	S	*	*			trans	-85.8	129.1	-174.6	22.6	-11.4	0	0	0	112.7
652	L	29.5	Very low	28.6	Very low	159 Å²	159	142.1 Å²	142.1	83%	0.832	83%	0.825	S	S	*	*			trans	-111.6	104.8	173.9	-84.8	166.5	0	0	0	111.7
653	K	29	Very low	28.8	Very low	196 Å²	196	139 Å²	139	85%	0.852	82%	0.823	S	S	*	*			trans	41.9	123.8	135.9	-65.7	-170.4	174.8	-176.9	0	120.8
654	A	24.9	Very low	28.6	Very low	107 Å²	107	138.8 Å²	138.8	88%	0.884	82%	0.823	S	S	*	*			trans	-78.6	129.6	159.2	0	0	0	0	0	112.5
655	S	25.6	Very low	28.5	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	82%	0.819	S	S	*	*			trans	-173.9	146.1	152.2	82.9	0	0	0	0	104.6
656	D	31.4	Very low	28.4	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	82%	0.815	S	S	*	*			cis	-154.9	157.5	26.5	-85.7	-58	0	0	0	110.5
657	M	26.8	Very low	28.2	Very low	176 Å²	176	136.1 Å²	136.1	87%	0.867	81%	0.806	S	S	*	*			trans	-66.6	131.9	174.1	-68.2	-121.4	-86.3	0	0	112.4
658	A	33.5	Very low	28.3	Very low	106 Å²	106	137.8 Å²	137.8	88%	0.876	81%	0.812	S	S	*	*			trans	-120.3	99.9	162.4	0	0	0	0	0	109.2
659	T	25.4	Very low	28.3	Very low	122 Å²	122	138.1 Å²	138.1	75%	0.748	80%	0.799	S	S	*	*			trans	-91.1	125.9	171.2	-42.1	0	0	0	0	108.3
660	L	27.2	Very low	28.2	Very low	170 Å²	170	136.4 Å²	136.4	89%	0.89	80%	0.801	S	S	*	*			trans	-143.5	137.8	164.2	-159.3	69.2	0	0	0	110.1
661	P	31.2	Very low	28.2	Very low	112 Å²	112	141.1 Å²	141.1	73%	0.727	81%	0.805	S	S	*	*			trans	-104.4	168.1	-147.8	38.7	-33	0	0	0	115.8
662	K	25.5	Very low	28.4	Very low	207 Å²	207	145.1 Å²	145.1	90%	0.9	81%	0.81	S	S	*	*			trans	-58.6	145.6	172.3	-65.9	168.2	175.3	174.9	0	112.9
663	S	32.6	Very low	28.3	Very low	117 Å²	117	143.7 Å²	143.7	82%	0.818	81%	0.807	S	S	*	*			trans	-134.8	131.5	161.8	50.9	0	0	0	0	110.6
664	D	24.6	Very low	28.3	Very low	156 Å²	156	139.8 Å²	139.8	83%	0.834	80%	0.804	S	S	*	*			trans	-67.7	158.6	-177.3	-63.6	-59.4	0	0	0	114.9
665	S	27.6	Very low	28.3	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	80%	0.799	S	S	*	*				157.5	114.3	109.6	72	0	0	0	0	114.7
666	T	26.5	Very low	28.5	Very low	129 Å²	129	148.4 Å²	148.4	79%	0.791	81%	0.81	S	S	*	*				61.3	98.8	127.2	-15.8	0	0	0	0	123.2
667	F	23.6	Very low	28.3	Very low	172 Å²	172	147.2 Å²	147.2	75%	0.754	81%	0.808	S	S	*	*				27.4	117.8	118.2	-128.6	-101.9	0	0	0	120.1	D669	F667-D669 HydrophobicContact CD1-CB 4.24Å; F667-D669 HydrophobicContact CE1-CB 3.93Å
668	T	31.7	Very low	28.5	Very low	138 Å²	138	144.4 Å²	144.4	85%	0.847	81%	0.806	S	S	*	*			trans	-135.3	112	150.9	51.2	0	0	0	0	109.8
669	D	29.1	Very low	28.3	Very low	113 Å²	113	148.2 Å²	148.2	60%	0.604	81%	0.806	S	S	*	*			trans	-89.5	134	177.7	-156	-7.3	0	0	0	108.6	F667	F667-D669 HydrophobicContact CD1-CB 4.24Å; F667-D669 HydrophobicContact CE1-CB 3.93Å
670	S	31.2	Very low	28.6	Very low	119 Å²	119	148 Å²	148	83%	0.832	81%	0.808	S	S	*	*			trans	-141.2	89.3	176.2	-79.7	0	0	0	0	110
671	K	28.7	Very low	28.4	Very low	183 Å²	183	143.3 Å²	143.3	80%	0.796	80%	0.8	S	S	*	*			trans	-73.6	124.7	164.8	-73.6	178.4	177.1	174.1	0	109.9
672	K	31.7	Very low	28.4	Very low	211 Å²	211	145.5 Å²	145.5	92%	0.917	81%	0.806	S	S	*	*			trans	-147.6	99.7	152.4	-140.1	173	-174.8	178.1	0	110.3
673	V	26.9	Very low	28.5	Very low	130 Å²	130	141.3 Å²	141.3	79%	0.788	80%	0.803	S	S	*	*			trans	-91.1	129.4	169.1	174.3	0	0	0	0	107.3
674	S	29.2	Very low	28.2	Very low	113 Å²	113	143.6 Å²	143.6	79%	0.79	80%	0.8	S	S	*	*			trans	-152.3	111.3	159.8	-174.9	0	0	0	0	109.7
675	N	25.4	Very low	28.5	Very low	142 Å²	142	142.6 Å²	142.6	76%	0.759	79%	0.792	S	S	*	*			trans	-68.2	139	173.2	-67.5	-38.8	0	0	0	111
676	R	29.2	Very low	28.6	Very low	244 Å²	244	143.8 Å²	143.8	92%	0.921	79%	0.79	S	S	*	*			trans	-138.9	115	149	-81.7	-165	178.3	-165.6	-0.5	109.9
677	T	26	Very low	28.6	Very low	126 Å²	126	146.9 Å²	146.9	77%	0.773	80%	0.796	S	S	*	*			trans	-73.2	133.1	169.7	-21.3	0	0	0	0	109.4
678	S	32.8	Very low	28.7	Very low	116 Å²	116	146.4 Å²	146.4	81%	0.811	80%	0.799	S	S	*	*			trans	-155.9	98.5	152	62.2	0	0	0	0	109.1
679	E	28.6	Very low	28.6	Very low	187 Å²	187	145 Å²	145	87%	0.874	79%	0.794	S	S	*	*			trans	-69.8	131	164	-69.4	169.3	142.5	0	0	108.8
680	C	30.4	Very low	28.4	Very low	118 Å²	118	145.4 Å²	145.4	80%	0.797	81%	0.805	S	S	*	*			trans	-142.8	94.7	159.2	-162.2	0	0	0	0	107
681	G	25	Very low	28.3	Very low	71 Å²	71	145.5 Å²	145.5	73%	0.732	81%	0.805	S	S	*	*			trans	-78.4	121.9	170.8	0	0	0	0	0	109.6
682	N	30.6	Very low	28.1	Very low	158 Å²	158	146 Å²	146	85%	0.845	81%	0.807	S	S	*	*			trans	-122	96.8	161.4	-83.5	-10	0	0	0	107.3
683	S	27	Very low	27.9	Very low	119 Å²	119	142.1 Å²	142.1	83%	0.832	80%	0.801	S	S	*	*			trans	-100.4	113.9	165.8	54	0	0	0	0	108.2
684	H	27.1	Very low	27.7	Very low	165 Å²	165	141 Å²	141	76%	0.764	80%	0.799	S	S	*	*			trans	-148.2	105.8	168.6	-159.2	58.9	0	0	0	111.8
685	M	29.5	Very low	27.6	Very low	134 Å²	134	145 Å²	145	66%	0.66	80%	0.802	S	S	*	*			trans	63.7	116.2	141.9	-56.5	-58.7	-171.6	0	0	122.1
686	D	31.5	Very low	27.5	Very low	131 Å²	131	143.9 Å²	143.9	70%	0.701	80%	0.801	S	S	*	*				62.5	92.5	117.9	-54.7	-14.7	0	0	0	121	I688	D686-I688 PolarHBondContact O-N 2.77Å
687	E	25	Very low	27.6	Very low	195 Å²	195	139.6 Å²	139.6	91%	0.911	79%	0.794	S	S	*	*				18.5	86	114.1	-156.6	174.5	-142	0	0	118.6
688	I	26.1	Very low	27.5	Very low	162 Å²	162	138 Å²	138	83%	0.831	79%	0.789	S	S	*	*			trans	-148.9	112.7	151	-52.8	178.5	0	0	0	109	D686	D686-I688 PolarHBondContact O-N 2.77Å
689	C	29.7	Very low	27.1	Very low	108 Å²	108	139 Å²	139	73%	0.73	79%	0.785	S	S	*	*				176	103.1	120.2	-148.3	0	0	0	0	111.4	C691	C689-C691 PolarHBondContact O-N 3.07Å
690	S	24.8	Very low	27.3	Very low	121 Å²	121	138.5 Å²	138.5	85%	0.846	79%	0.788	S	S	*	*			trans	-77.2	103	167.9	-59.4	0	0	0	0	110.3	K692	S690-K692 PolarHBondContact O-N 3.05Å
691	C	29.7	Very low	27.2	Very low	122 Å²	122	137.5 Å²	137.5	82%	0.824	79%	0.788	S	S	*	*			trans	-87.1	93.7	165.6	-67.7	0	0	0	0	110.2	C689	C689-C691 PolarHBondContact O-N 3.07Å
692	K	23.7	Very low	27.6	Very low	192 Å²	192	140 Å²	140	84%	0.835	79%	0.792	S	S	*	*			trans	-74.6	137.2	156.3	-88	174.6	171.6	173	0	109.4	S690	S690-K692 PolarHBondContact O-N 3.05Å
693	T	27.4	Very low	27.8	Very low	131 Å²	131	138.8 Å²	138.8	80%	0.804	79%	0.792	S	S	*	*			trans	147.4	101.6	142.5	42.1	0	0	0	0	109.7
694	S	23.6	Very low	27.7	Very low	105 Å²	105	136.7 Å²	136.7	73%	0.734	79%	0.79	S	S	*	*				56.5	97.3	83.1	69.4	0	0	0	0	115.5
695	K	26.2	Very low	27.6	Very low	199 Å²	199	134.9 Å²	134.9	87%	0.865	80%	0.795	S	S	*	*			trans	-174.4	104.9	144.2	-110.5	168.8	174.5	180	0	110
696	T	24.2	Very low	27.7	Very low	118 Å²	118	133.5 Å²	133.5	72%	0.724	80%	0.796	S	S	*	*				95.3	140.8	87.9	-48.8	0	0	0	0	112.2
697	I	30.5	Very low	27.5	Very low	154 Å²	154	135.7 Å²	135.7	79%	0.79	81%	0.808	S	S	*	*			trans	82.6	101	166.7	-39.9	175.5	0	0	0	112.8
698	S	24	Very low	27.5	Very low	93 Å²	93	131.6 Å²	131.6	65%	0.65	80%	0.801	S	S	*	*			cis	58.1	115.5	36.9	-148.2	0	0	0	0	116.6
699	N	24.8	Very low	27.6	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	80%	0.801	S	S	*	*			trans	90.9	106.1	157.6	-50.3	-20.3	0	0	0	116.7
700	N	33.1	Very low	27.3	Very low	175 Å²	175	133.5 Å²	133.5	94%	0.936	81%	0.806	S	S	*	*			trans	-167.1	96.7	130.9	-85.9	-30	0	0	0	109.7
701	A	28	Very low	27.5	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	80%	0.801	S	S	*	*			trans	-115.9	142.7	148.6	0	0	0	0	0	105.6
702	P	32.9	Very low	27.4	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	79%	0.793	S	S	*	*				-146.9	-178.9	78.8	35.3	-13.4	0	0	0	114.3
703	P	35	Very low	27.8	Very low	132 Å²	132	130.7 Å²	130.7	86%	0.857	79%	0.792	S	S	*	*			trans	-104.3	165.2	-161.7	38.7	-29.6	0	0	0	114.5
704	G	25.6	Very low	27.6	Very low	75 Å²	75	127.7 Å²	127.7	77%	0.773	79%	0.787	S	S	*	*			trans	-149.3	99.3	178.7	0	0	0	0	0	114.9
705	S	24.5	Very low	27.8	Very low	126 Å²	126	128.2 Å²	128.2	88%	0.881	79%	0.788	S	S	*	*			trans	69.7	150.5	141.3	-82.8	0	0	0	0	124.3
706	P	32.4	Very low	28	Very low	105 Å²	105	125.9 Å²	125.9	68%	0.682	79%	0.785	S	S	*	*			trans	-113	147.6	-151.9	38.2	-24.2	0	0	0	113.6	S708	P706-S708 PolarHBondContact O-N 3.03Å
707	N	27.1	Very low	28.1	Very low	177 Å²	177	129.2 Å²	129.2	95%	0.947	79%	0.793	S	S	*	*			trans	-91.5	95.2	162.5	-76.4	-29.2	0	0	0	109.1
708	S	24.2	Very low	27.9	Very low	109 Å²	109	128.9 Å²	128.9	76%	0.762	79%	0.791	S	S	*	*			trans	-86.1	116.4	161.9	65.5	0	0	0	0	109	P706	P706-S708 PolarHBondContact O-N 3.03Å
709	S	27.9	Very low	27.9	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	79%	0.792	S	S	*	*			trans	-127.4	118.4	154.7	67.4	0	0	0	0	107.8
710	F	23.7	Very low	28	Very low	192 Å²	192	129.9 Å²	129.9	84%	0.842	79%	0.794	S	S	*	*			trans	-94.3	120.4	-166.9	-157.6	-99.8	0	0	0	106.6
711	V	29.7	Very low	27.8	Very low	121 Å²	121	129.1 Å²	129.1	73%	0.733	79%	0.785	S	S	*	*			trans	-118.2	110.9	166	179.8	0	0	0	0	107.2	N713	V711-N713 PolarHBondContact O-N 3.29Å
712	P	26.9	Very low	27.7	Very low	101 Å²	101	132.7 Å²	132.7	66%	0.656	79%	0.789	S	S	*	*			trans	-84.3	110.1	-179	31.6	-28.3	0	0	0	109.2
713	N	31.3	Very low	27.4	Very low	153 Å²	153	134.9 Å²	134.9	82%	0.818	79%	0.789	S	S	*	*			trans	-116.1	109	165	-90.7	-26.9	0	0	0	109.1	V711	V711-N713 PolarHBondContact O-N 3.29Å
714	G	24.9	Very low	26.9	Very low	68 Å²	68	133.9 Å²	133.9	70%	0.701	78%	0.775	S	S	*	*			trans	69.8	109	143.3	0	0	0	0	0	118.1
715	P	27.1	Very low	26.9	Very low	116 Å²	116	134.5 Å²	134.5	75%	0.753	77%	0.768	S	S	*	*	S	Bend	trans	-71	151.5	160.5	33.6	-30.3	0	0	0	109.1
716	N	29.8	Very low	27	Very low	150 Å²	150	132.9 Å²	132.9	80%	0.802	76%	0.762	S	S	*	*			trans	110	28.6	172.2	-53.2	-19.9	0	0	0	117.7
717	Q	27.2	Very low	26.8	Very low	189 Å²	189	136 Å²	136	88%	0.883	77%	0.767	S	S	*	*			trans	-107.1	82.5	149.7	-70.9	-174.3	14.1	0	0	108.4	P719	Q717-P719 VanDerWaalsContact O-CD 3.31Å; Q717-P719 WeakPolarHBondContact O-CD 3.43Å
718	I	25.4	Very low	26.8	Very low	146 Å²	146	132.7 Å²	132.7	75%	0.749	75%	0.748	S	S	*	*			trans	-68.2	118.6	160.1	-64	170.8	0	0	0	105.2	L720	I718-L720 PolarHBondContact O-N 3.19Å
719	P	25.4	Very low	26.9	Very low	105 Å²	105	131.3 Å²	131.3	68%	0.682	74%	0.739	S	S	*	*			trans	-65.5	108.2	178	-15.5	29.9	0	0	0	108.7	Q717 E721	Q717-P719 VanDerWaalsContact O-CD 3.31Å; Q717-P719 WeakPolarHBondContact O-CD 3.43Å; P719-E721 PolarHBondContact O-N 3.12Å
720	L	26.6	Very low	26.9	Very low	146 Å²	146	134.7 Å²	134.7	76%	0.764	74%	0.738	S	S	*	*			trans	-69.8	58.1	168.4	-98.5	146.7	0	0	0	109.6	I718	I718-L720 PolarHBondContact O-N 3.19Å
721	E	27.6	Very low	27	Very low	159 Å²	159	130.5 Å²	130.5	74%	0.743	73%	0.733	S	S	*	*			trans	-109.2	9.4	-175.7	-142.3	179.1	179.9	0	0	114.1	P719	P719-E721 PolarHBondContact O-N 3.12Å
722	L	26.7	Very low	26.8	Very low	172 Å²	172	134.9 Å²	134.9	90%	0.901	74%	0.736	S	S	*	*	S	Bend	trans	-124.6	9.8	179.9	-75.4	175.9	0	0	0	116.5
723	Q	26.7	Very low	26.8	Very low	171 Å²	171	136.9 Å²	136.9	80%	0.799	74%	0.741	S	S	*	*	S	Bend	trans	-122.3	3.7	-175.7	-122.9	172.1	-0.3	0	0	117.2
724	I	25.3	Very low	26.7	Very low	111 Å²	111	140 Å²	140	57%	0.569	74%	0.741	S	S	*	*	S	Bend	trans	-121.9	-7	-179.5	-55	-179.9	0	0	0	113.4	A726 I728	I724-A726 PolarHBondContact O-N 3.37Å; I724-I728 HydrophobicContact CG2-CD1 3.36Å; I724-I728 HydrophobicContact CG2-CG1 4.04Å
725	S	24.8	Very low	26.8	Very low	89 Å²	89	144 Å²	144	62%	0.622	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-9.4	-173.1	-10.7	0	0	0	0	115.1	S729	S725-S729 PolarHBondContact O-OG 3.41Å
726	A	26.3	Very low	26.8	Very low	91 Å²	91	145.1 Å²	145.1	75%	0.752	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-28.8	-175.4	0	0	0	0	0	114.9	I724	I724-A726 PolarHBondContact O-N 3.37Å
727	E	28.1	Very low	26.9	Very low	172 Å²	172	145 Å²	145	80%	0.804	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	-23.4	-171.4	-79.5	-171.6	153.6	0	0	115.1
728	I	27.4	Very low	27	Very low	107 Å²	107	142.7 Å²	142.7	55%	0.549	74%	0.737	S	S	.	*	S	Bend	trans	-92.3	-11.3	-173.8	-39.6	-173.8	0	0	0	112.9	I724	I724-I728 HydrophobicContact CG2-CD1 3.36Å; I724-I728 HydrophobicContact CG2-CG1 4.04Å
729	S	26.1	Very low	27	Very low	80 Å²	80	142.4 Å²	142.4	56%	0.559	73%	0.734	S	S	*	*	S	Bend	trans	-85.5	-5	-175.5	46.5	0	0	0	0	115.5	S725	S725-S729 PolarHBondContact O-OG 3.41Å
730	K	28.1	Very low	27.2	Very low	190 Å²	190	142.9 Å²	142.9	83%	0.826	74%	0.737	S	S	*	*	S	Bend	trans	-104.3	-18.6	175	-83.3	179.1	179.2	172.1	0	115.4
731	S	26.6	Very low	27.3	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	74%	0.743	S	S	*	*	S	Bend	trans	-94.7	-7.9	-170	-46.8	0	0	0	0	114.7
732	R	25.1	Very low	27.3	Very low	213 Å²	213	139.3 Å²	139.3	80%	0.804	74%	0.74	S	S	*	*	S	Bend	trans	-110.9	-6.6	-176.3	-98.6	-176.8	161.6	-179.1	-4.9	117.1
733	L	26.2	Very low	27.6	Very low	142 Å²	142	138.4 Å²	138.4	74%	0.743	74%	0.736	S	S	*	*	S	Bend	trans	-96.7	23.7	-178.6	-77.7	172.9	0	0	0	115.2
734	R	30.1	Very low	27.9	Very low	218 Å²	218	137.6 Å²	137.6	82%	0.823	74%	0.737	S	S	*	*	S	Bend	trans	-127.8	-3.7	176.5	-74.8	-170.1	178.8	164.6	0.3	116.9
735	L	26.7	Very low	28.2	Very low	154 Å²	154	142.3 Å²	142.3	81%	0.806	75%	0.753	S	S	*	*	S	Bend	trans	-96.2	-12.7	177.8	-142	75.7	0	0	0	114
736	L	27.5	Very low	28.5	Very low	139 Å²	139	145.4 Å²	145.4	73%	0.728	76%	0.762	S	S	*	*	S	Bend	trans	-99.4	-15.5	-179.7	-73.4	166.1	0	0	0	114.4	L738	L736-L738 VanDerWaalsContact C-N 3.29Å; L736-L738 PolarHBondContact O-N 3.11Å
737	D	30.7	Very low	28.5	Very low	146 Å²	146	143.6 Å²	143.6	78%	0.781	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-2.3	175.5	-75.7	-15.2	0	0	0	113.7
738	L	29	Very low	28.7	Very low	141 Å²	141	147 Å²	147	74%	0.738	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	2.1	174.1	-77.4	168.2	0	0	0	113.4	L736 P740	L736-L738 VanDerWaalsContact C-N 3.29Å; L736-L738 PolarHBondContact O-N 3.11Å; L738-P740 WeakPolarHBondContact O-CD 3.23Å
739	M	25.3	Very low	29	Very low	140 Å²	140	150.5 Å²	150.5	69%	0.69	77%	0.772	S	S	*	*	S	Bend	trans	-91	100.8	165.8	-70.4	-153.9	68.9	0	0	108.2	N741	M739-N741 PolarHBondContact O-N 3.36Å
740	P	31.4	Very low	29	Very low	116 Å²	116	150.7 Å²	150.7	75%	0.753	77%	0.772	S	S	*	*			trans	-57.5	120.7	171.3	23.8	-31.1	0	0	0	107.1	L738 G742	L738-P740 WeakPolarHBondContact O-CD 3.23Å; P740-G742 VanDerWaalsContact C-N 3.29Å; P740-G742 PolarHBondContact O-N 3.32Å
741	N	28.7	Very low	29.1	Very low	164 Å²	164	147.4 Å²	147.4	88%	0.877	77%	0.768	S	S	*	*			trans	-50.4	101.1	168.6	-80.4	-29.5	0	0	0	107.5	M739 D743	M739-N741 PolarHBondContact O-N 3.36Å; N741-D743 PolarHBondContact O-N 3.12Å
742	G	27.8	Very low	29.2	Very low	66 Å²	66	149.7 Å²	149.7	68%	0.68	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	114	177	0	0	0	0	0	107.6	P740	P740-G742 VanDerWaalsContact C-N 3.29Å; P740-G742 PolarHBondContact O-N 3.32Å
743	D	32.5	Very low	29.5	Very low	153 Å²	153	146.6 Å²	146.6	82%	0.818	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169	2	144.9	-90.5	-18.1	0	0	0	112.9	N741	N741-D743 PolarHBondContact O-N 3.12Å
744	N	32.5	Very low	29.9	Very low	154 Å²	154	147.7 Å²	147.7	82%	0.824	77%	0.771	S	S	*	*	S	Bend	trans	-105.2	101.8	176.2	-69.1	-31.1	0	0	0	111.3	L746	N744-L746 VanDerWaalsContact C-N 3.32Å; N744-L746 PolarHBondContact O-N 3.1Å
745	K	31.2	Very low	30.2	Very low	209 Å²	209	141.7 Å²	141.7	91%	0.909	76%	0.762	S	S	*	*			trans	-34.7	84.6	164.1	-59.6	174.2	-179.2	179.4	0	112.4	G747	K745-G747 PolarHBondContact O-N 3.01Å; K745-G747 VanDerWaalsContact O-N 3.15Å
746	L	31.1	Very low	30.8	Very low	155 Å²	155	139.1 Å²	139.1	81%	0.812	75%	0.748	S	S	*	*			trans	-71.6	106.9	159.7	-81	161.6	0	0	0	106.1	N744	N744-L746 VanDerWaalsContact C-N 3.32Å; N744-L746 PolarHBondContact O-N 3.1Å
747	G	27	Very low	31.5	Very low	53 Å²	53	136.5 Å²	136.5	55%	0.546	74%	0.735	S	S	.	*			trans	-55.7	166	178.7	0	0	0	0	0	112.3	K745 E749	K745-G747 PolarHBondContact O-N 3.01Å; K745-G747 VanDerWaalsContact O-N 3.15Å; G747-E749 PolarHBondContact O-N 2.96Å
748	R	32.4	Very low	32.2	Very low	242 Å²	242	134.3 Å²	134.3	91%	0.913	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-54	6.5	-174.4	-80.8	-172.7	-172.2	-162.3	2.2	117.1	T751	R748-T751 PolarHBondContact O-OG1 3.4Å
749	E	33.2	Very low	32.6	Very low	181 Å²	181	132.8 Å²	132.8	85%	0.846	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-91.6	-4.4	-169.7	-59.2	-165.8	179.6	0	0	114.3	G747 T751	G747-E749 PolarHBondContact O-N 2.96Å; E749-T751 VanDerWaalsContact C-N 3.34Å; E749-T751 PolarHBondContact O-N 3.49Å
750	C	26.3	Very low	33.3	Very low	85 Å²	85	129.7 Å²	129.7	57%	0.574	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-86	10.5	176.9	-65	0	0	0	0	115.4	H752	C750-H752 VanDerWaalsContact C-N 3.31Å; C750-H752 PolarHBondContact O-N 2.96Å
751	T	30	Very low	33.7	Very low	121 Å²	121	127.8 Å²	127.8	74%	0.742	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-81.5	0.3	178.1	43.1	0	0	0	0	115.1	R748 E749	R748-T751 PolarHBondContact O-OG1 3.4Å; E749-T751 VanDerWaalsContact C-N 3.34Å; E749-T751 PolarHBondContact O-N 3.49Å
752	H	28.9	Very low	34.3	Very low	151 Å²	151	129.1 Å²	129.1	70%	0.699	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-106.9	5.3	-174.6	-96.2	-72.9	0	0	0	117.1	C750 L754	C750-H752 VanDerWaalsContact C-N 3.31Å; C750-H752 PolarHBondContact O-N 2.96Å; H752-L754 VanDerWaalsContact C-N 3.31Å; H752-L754 PolarHBondContact O-N 3.21Å
753	I	31.5	Very low	34.6	Very low	149 Å²	149	131.5 Å²	131.5	76%	0.764	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-1.9	-176.7	-58.4	177.6	0	0	0	113.6
754	L	34.8	Very low	35	Very low	165 Å²	165	128.7 Å²	128.7	86%	0.864	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	14.4	178.6	-66.2	178	0	0	0	115.1	H752 I756	H752-L754 VanDerWaalsContact C-N 3.31Å; H752-L754 PolarHBondContact O-N 3.21Å; L754-I756 VanDerWaalsContact C-N 3.31Å; L754-I756 PolarHBondContact O-N 3.17Å
755	S	35.7	Very low	35.5	Very low	92 Å²	92	125.9 Å²	125.9	64%	0.643	65%	0.65	S	S	*	*			trans	-79.8	80	172.2	-54.5	0	0	0	0	110.3	D757	S755-D757 PolarHBondContact O-N 3.46Å
756	I	38.7	Very low	36.4	Very low	99 Å²	99	118.6 Å²	118.6	51%	0.508	63%	0.625	S	S	.	*			trans	-61.2	127.9	166.7	-63.1	171.7	0	0	0	107.5	L754 V760	L754-I756 VanDerWaalsContact C-N 3.31Å; L754-I756 PolarHBondContact O-N 3.17Å; I756-V760 HydrophobicContact CG2-CB 3.95Å; I756-V760 HydrophobicContact CG2-CG1 4.06Å
757	D	42.4	Very low	37	Very low	84 Å²	84	116.2 Å²	116.2	45%	0.449	61%	0.61	S	S	.	*			trans	-50.3	129	177.5	-173.2	-55.9	0	0	0	110.1	S755 N759 V760 Q761	S755-D757 PolarHBondContact O-N 3.46Å; D757-N759 PolarHBondContact O-N 3.36Å; D757-N759 VanDerWaalsContact OD1-CB 3.26Å; D757-N759 WeakPolarHBondContact OD1-CB 3.24Å; D757-N759 PolarHBondContact OD1-N 3.25Å; D757-N759 PolarHBondContact OD1-ND2 2.94Å; D757-V760 HydrophobicContact CB-CG2 4.12Å; D757-V760 PolarHBondContact O-N 3.41Å; D757-Q761 PolarHBondContact O-N 2.96Å; D757-Q761 VanDerWaalsContact O-N 3.17Å
758	P	45.2	Very low	37.4	Very low	100 Å²	100	115.2 Å²	115.2	65%	0.649	60%	0.599	S	S	*	*	H	α-helix	trans	-52.9	-27.1	-178.6	-25.7	32.5	0	0	0	114	R762	P758-R762 WeakPolarHBondContact O-CB 3.27Å; P758-R762 PolarHBondContact O-N 3.3Å
759	N	38.1	Very low	38	Very low	110 Å²	110	106 Å²	106	59%	0.588	58%	0.575	S	S	*	*	H	α-helix	trans	-71.9	-36.9	177	-64.5	-55.2	0	0	0	112.3	D757 R762 L763	D757-N759 PolarHBondContact O-N 3.36Å; D757-N759 VanDerWaalsContact OD1-CB 3.26Å; D757-N759 WeakPolarHBondContact OD1-CB 3.24Å; D757-N759 PolarHBondContact OD1-N 3.25Å; D757-N759 PolarHBondContact OD1-ND2 2.94Å; N759-R762 PolarHBondContact O-N 3.03Å; N759-L763 PolarHBondContact O-N 2.73Å
760	V	40.7	Very low	38.1	Very low	75 Å²	75	104.2 Å²	104.2	46%	0.455	56%	0.564	S	S	.	*	H	α-helix	trans	-69.3	-40.6	175.7	-179.5	0	0	0	0	109.8	I756 D757 R762 L763 I764	I756-V760 HydrophobicContact CG2-CB 3.95Å; I756-V760 HydrophobicContact CG2-CG1 4.06Å; D757-V760 HydrophobicContact CB-CG2 4.12Å; D757-V760 PolarHBondContact O-N 3.41Å; V760-R762 PolarHBondContact O-N 2.68Å; V760-L763 WeakPolarHBondContact O-CB 3.41Å; V760-L763 PolarHBondContact O-N 2.88Å; V760-I764 HydrophobicContact CG1-CD1 4.16Å; V760-I764 WeakPolarHBondContact O-CG1 3.32Å; V760-I764 PolarHBondContact O-N 3Å
761	Q	40.1	Very low	38.5	Very low	76 Å²	76	105.6 Å²	105.6	36%	0.355	57%	0.565	S	S	.	*	H	α-helix	trans	-64.4	-38.7	174.7	-166.7	63.8	54.9	0	0	112.1	D757 L763 I764 N765	D757-Q761 PolarHBondContact O-N 2.96Å; D757-Q761 VanDerWaalsContact O-N 3.17Å; Q761-L763 VanDerWaalsContact C-N 3.34Å; Q761-I764 PolarHBondContact O-N 3.25Å; Q761-N765 PolarHBondContact NE2-OD1 2.72Å; Q761-N765 VanDerWaalsContact NE2-OD1 3.13Å; Q761-N765 WeakPolarHBondContact O-CB 3.48Å; Q761-N765 PolarHBondContact O-N 3.47Å; Q761-N765 PolarHBondContact O-ND2 3.12Å; Q761-N765 PolarHBondContact O-OD1 3Å
762	R	39.3	Very low	39.1	Very low	191 Å²	191	104.6 Å²	104.6	72%	0.721	55%	0.554	S	S	*	*	H	α-helix	trans	-61.6	-41	171.9	-95.5	-175.8	175.4	173.6	-0.3	112.3	P758 N759 V760 N765 S766	P758-R762 WeakPolarHBondContact O-CB 3.27Å; P758-R762 PolarHBondContact O-N 3.3Å; N759-R762 PolarHBondContact O-N 3.03Å; V760-R762 PolarHBondContact O-N 2.68Å; R762-N765 PolarHBondContact O-N 3.29Å; R762-S766 VanDerWaalsContact O-CB 3.29Å; R762-S766 WeakPolarHBondContact O-CB 3.29Å; R762-S766 PolarHBondContact O-N 2.99Å; R762-S766 PolarHBondContact O-OG 2.98Å
763	L	34.4	Very low	39.6	Very low	116 Å²	116	102.7 Å²	102.7	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-63.3	-47.7	179.5	-161.1	76.1	0	0	0	110.7	N759 V760 Q761 N765 S766 E767	N759-L763 PolarHBondContact O-N 2.73Å; V760-L763 WeakPolarHBondContact O-CB 3.41Å; V760-L763 PolarHBondContact O-N 2.88Å; Q761-L763 VanDerWaalsContact C-N 3.34Å; L763-N765 PolarHBondContact O-N 2.95Å; L763-S766 PolarHBondContact O-N 2.79Å; L763-S766 PolarHBondContact O-OG 3.03Å; L763-E767 PolarHBondContact O-N 2.88Å
764	I	41.9	Very low	39.8	Very low	95 Å²	95	102.5 Å²	102.5	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-59.1	-45.6	176.5	-64.9	166.7	0	0	0	110.9	V760 Q761 S766 G768	V760-I764 HydrophobicContact CG1-CD1 4.16Å; V760-I764 WeakPolarHBondContact O-CG1 3.32Å; V760-I764 PolarHBondContact O-N 3Å; Q761-I764 PolarHBondContact O-N 3.25Å; I764-S766 VanDerWaalsContact C-N 3.34Å; I764-S766 PolarHBondContact O-N 3.13Å; I764-G768 PolarHBondContact O-N 2.86Å
765	N	43.4	Very low	39.6	Very low	95 Å²	95	98.5 Å²	98.5	51%	0.508	53%	0.528	S	S	.	.	H	α-helix	trans	-67.9	-34.2	179.9	-66	-5.2	0	0	0	112.1	Q761 R762 L763 A769	Q761-N765 PolarHBondContact NE2-OD1 2.72Å; Q761-N765 VanDerWaalsContact NE2-OD1 3.13Å; Q761-N765 WeakPolarHBondContact O-CB 3.48Å; Q761-N765 PolarHBondContact O-N 3.47Å; Q761-N765 PolarHBondContact O-ND2 3.12Å; Q761-N765 PolarHBondContact O-OD1 3Å; R762-N765 PolarHBondContact O-N 3.29Å; L763-N765 PolarHBondContact O-N 2.95Å; N765-A769 WeakPolarHBondContact O-CB 3.32Å; N765-A769 PolarHBondContact O-N 3.38Å; N765-A769 VanDerWaalsContact O-N 3.14Å
766	S	49.7	Very low	39.5	Very low	56 Å²	56	100.2 Å²	100.2	39%	0.392	53%	0.526	S	S	.	.	H	α-helix	trans	-75.3	-37.7	179.6	73.4	0	0	0	0	113.6	R762 L763 I764 K770	R762-S766 VanDerWaalsContact O-CB 3.29Å; R762-S766 WeakPolarHBondContact O-CB 3.29Å; R762-S766 PolarHBondContact O-N 2.99Å; R762-S766 PolarHBondContact O-OG 2.98Å; L763-S766 PolarHBondContact O-N 2.79Å; L763-S766 PolarHBondContact O-OG 3.03Å; I764-S766 VanDerWaalsContact C-N 3.34Å; I764-S766 PolarHBondContact O-N 3.13Å; S766-K770 PolarHBondContact O-N 3.4Å
767	E	42.8	Very low	39.4	Very low	105 Å²	105	99.7 Å²	99.7	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-74.9	-41.1	175.3	-85	-77.9	139.1	0	0	111	L763 A769 K770 L771	L763-E767 PolarHBondContact O-N 2.88Å; E767-A769 PolarHBondContact O-N 3.46Å; E767-K770 PolarHBondContact O-N 3.01Å; E767-L771 PolarHBondContact O-N 2.87Å; E767-L771 VanDerWaalsContact O-N 3.15Å
768	G	36.7	Very low	39	Very low	31 Å²	31	103.1 Å²	103.1	32%	0.32	54%	0.544	S	S	.	.	H	α-helix	trans	-60.2	-43.6	176	0	0	0	0	0	112.7	I764 K770 L771 I772	I764-G768 PolarHBondContact O-N 2.86Å; G768-K770 VanDerWaalsContact C-N 3.34Å; G768-K770 PolarHBondContact O-N 3.47Å; G768-L771 PolarHBondContact O-N 2.93Å; G768-I772 WeakPolarHBondContact O-CG1 3.03Å; G768-I772 PolarHBondContact O-N 3.36Å
769	A	43.2	Very low	38.2	Very low	49 Å²	49	108.3 Å²	108.3	41%	0.405	55%	0.552	S	S	.	*	H	α-helix	trans	-66.6	-32.9	177.6	0	0	0	0	0	113.1	N765 E767 L771 N773	N765-A769 WeakPolarHBondContact O-CB 3.32Å; N765-A769 PolarHBondContact O-N 3.38Å; N765-A769 VanDerWaalsContact O-N 3.14Å; E767-A769 PolarHBondContact O-N 3.46Å; A769-L771 VanDerWaalsContact C-N 3.34Å; A769-N773 PolarHBondContact O-N 2.78Å
770	K	36.5	Very low	37.6	Very low	144 Å²	144	107.7 Å²	107.7	63%	0.626	56%	0.557	S	S	*	*	H	α-helix	trans	-68	-34.5	174.8	-79.7	178.3	-178.2	173.1	0	112.4	S766 E767 G768 K774	S766-K770 PolarHBondContact O-N 3.4Å; E767-K770 PolarHBondContact O-N 3.01Å; G768-K770 VanDerWaalsContact C-N 3.34Å; G768-K770 PolarHBondContact O-N 3.47Å; K770-K774 PolarHBondContact O-N 3.34Å
771	L	34.6	Very low	37.1	Very low	113 Å²	113	113.9 Å²	113.9	59%	0.592	58%	0.578	S	S	*	*	H	α-helix	trans	-74.2	-41.6	178	-81.4	158.5	0	0	0	111.9	E767 G768 A769 K774 C775	E767-L771 PolarHBondContact O-N 2.87Å; E767-L771 VanDerWaalsContact O-N 3.15Å; G768-L771 PolarHBondContact O-N 2.93Å; A769-L771 VanDerWaalsContact C-N 3.34Å; L771-K774 PolarHBondContact O-N 3.44Å; L771-C775 PolarHBondContact O-N 3.42Å
772	I	41.6	Very low	36.5	Very low	100 Å²	100	115.1 Å²	115.1	51%	0.513	60%	0.595	S	S	.	*	H	α-helix	trans	-64.5	-45.1	178.9	-65.7	168	0	0	0	111	G768 K774 C775 E776	G768-I772 WeakPolarHBondContact O-CG1 3.03Å; G768-I772 PolarHBondContact O-N 3.36Å; I772-K774 PolarHBondContact O-N 3.49Å; I772-C775 PolarHBondContact O-N 2.88Å; I772-E776 PolarHBondContact O-N 3.39Å; I772-E776 VanDerWaalsContact O-N 3.11Å
773	N	39.7	Very low	35.9	Very low	111 Å²	111	114.7 Å²	114.7	59%	0.594	60%	0.598	S	S	*	*	H	α-helix	trans	-66.5	-21.3	179.3	-75.6	-15	0	0	0	113.6	A769	A769-N773 PolarHBondContact O-N 2.78Å
774	K	37	Very low	35.5	Very low	145 Å²	145	113.9 Å²	113.9	63%	0.63	60%	0.602	S	S	*	*	H	α-helix	trans	-78.3	-39.3	175.8	-145.3	170.1	-175.3	-176.5	0	111.3	K770 L771 I772 S777	K770-K774 PolarHBondContact O-N 3.34Å; L771-K774 PolarHBondContact O-N 3.44Å; I772-K774 PolarHBondContact O-N 3.49Å; K774-S777 PolarHBondContact O-OG 2.94Å
775	C	30.5	Very low	34.7	Very low	82 Å²	82	115.5 Å²	115.5	55%	0.554	61%	0.612	S	S	*	*	H	α-helix	trans	-70.4	-33.9	177.5	-69.1	0	0	0	0	113.3	L771 I772 E778	L771-C775 PolarHBondContact O-N 3.42Å; I772-C775 PolarHBondContact O-N 2.88Å; C775-E778 PolarHBondContact O-N 2.93Å
776	E	33.9	Very low	33.8	Very low	127 Å²	127	118.1 Å²	118.1	59%	0.593	63%	0.626	S	S	*	*	H	α-helix	trans	-72.6	-29.4	178.2	-71.7	-173.7	176	0	0	113.2	I772 E778 Y779	I772-E776 PolarHBondContact O-N 3.39Å; I772-E776 VanDerWaalsContact O-N 3.11Å; E776-E778 VanDerWaalsContact C-N 3.3Å; E776-E778 PolarHBondContact O-N 2.71Å; E776-Y779 PolarHBondContact O-N 3.01Å
777	S	35.4	Very low	32.7	Very low	89 Å²	89	121.4 Å²	121.4	62%	0.622	65%	0.649	S	S	*	*	H	α-helix	trans	-70.6	-23.6	177.3	68.9	0	0	0	0	113.9	K774	K774-S777 PolarHBondContact O-OG 2.94Å
778	E	33.9	Very low	31.8	Very low	155 Å²	155	119.7 Å²	119.7	72%	0.724	66%	0.659	S	S	*	*	H	α-helix	trans	-92.3	-10	178.7	-71.5	-177.7	177.2	0	0	113.3	C775 E776	C775-E778 PolarHBondContact O-N 2.93Å; E776-E778 VanDerWaalsContact C-N 3.3Å; E776-E778 PolarHBondContact O-N 2.71Å
779	Y	27.9	Very low	31.2	Very low	210 Å²	210	121.7 Å²	121.7	82%	0.824	68%	0.68	S	S	*	*			trans	-107.1	13.4	-175.3	-98.2	-87.4	0	0	0	116	E776 F781	E776-Y779 PolarHBondContact O-N 3.01Å; Y779-F781 VanDerWaalsContact C-N 3.34Å; Y779-F781 PolarHBondContact O-N 2.88Å
780	S	26.7	Very low	30.1	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	70%	0.704	S	S	*	*			trans	-90.8	64.5	171.7	-66.1	0	0	0	0	111.9	S782	S780-S782 VanDerWaalsContact C-N 3.27Å; S780-S782 PolarHBondContact O-N 3.05Å; S780-S782 VanDerWaalsContact O-N 3.08Å
781	F	29.5	Very low	29.7	Very low	204 Å²	204	126.7 Å²	126.7	90%	0.895	70%	0.704	S	S	*	*			trans	-77.4	84.7	161.3	-126.2	-88.6	0	0	0	107.9	Y779 K783	Y779-F781 VanDerWaalsContact C-N 3.34Å; Y779-F781 PolarHBondContact O-N 2.88Å; F781-K783 PolarHBondContact O-N 3.48Å
782	S	28.9	Very low	29.2	Very low	103 Å²	103	129 Å²	129	72%	0.72	72%	0.715	S	S	*	*			trans	-63.9	100.7	172.1	-67.3	0	0	0	0	109.4	S780 S784	S780-S782 VanDerWaalsContact C-N 3.27Å; S780-S782 PolarHBondContact O-N 3.05Å; S780-S782 VanDerWaalsContact O-N 3.08Å; S782-S784 PolarHBondContact O-N 2.87Å
783	K	25.7	Very low	28.7	Very low	182 Å²	182	132.9 Å²	132.9	79%	0.791	73%	0.728	S	S	*	*			trans	-62.2	79.3	170.2	-162.4	176.1	-172.1	178.6	0	109.2	F781 N785	F781-K783 PolarHBondContact O-N 3.48Å; K783-N785 PolarHBondContact O-N 3.22Å; K783-N785 VanDerWaalsContact O-N 3.09Å
784	S	26.1	Very low	28	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	74%	0.735	S	S	*	*			trans	-78.4	91.4	174.5	54.6	0	0	0	0	109.8	S782 N786	S782-S784 PolarHBondContact O-N 2.87Å; S784-N786 VanDerWaalsContact C-N 3.31Å; S784-N786 PolarHBondContact O-N 2.97Å
785	N	24.1	Very low	27.4	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	74%	0.744	S	S	*	*			trans	-68.2	87.8	164.1	-69.7	-22.4	0	0	0	108.8	K783	K783-N785 PolarHBondContact O-N 3.22Å; K783-N785 VanDerWaalsContact O-N 3.09Å
786	N	25.7	Very low	27.4	Very low	149 Å²	149	138.7 Å²	138.7	80%	0.797	76%	0.759	S	S	*	*			trans	-106.5	75.8	168.6	-81.9	-17.4	0	0	0	110.2	S784 G788	S784-N786 VanDerWaalsContact C-N 3.31Å; S784-N786 PolarHBondContact O-N 2.97Å; N786-G788 VanDerWaalsContact C-N 3.28Å; N786-G788 PolarHBondContact O-N 2.74Å
787	S	25.4	Very low	26.9	Very low	125 Å²	125	140.7 Å²	140.7	87%	0.874	77%	0.773	S	S	*	*			trans	-75	84.8	150.6	54.9	0	0	0	0	107.9
788	G	24.8	Very low	26.6	Very low	69 Å²	69	141.7 Å²	141.7	71%	0.711	78%	0.78	S	S	*	*			trans	-125.3	101	178.6	0	0	0	0	0	109.8	N786	N786-G788 VanDerWaalsContact C-N 3.28Å; N786-G788 PolarHBondContact O-N 2.74Å
789	G	23.5	Very low	26	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	78%	0.782	S	S	*	*			trans	-57.3	152.6	-173.4	0	0	0	0	0	115.3	S791	G789-S791 PolarHBondContact O-N 2.77Å
790	F	21.7	Very low	26	Very low	209 Å²	209	133.2 Å²	133.2	92%	0.917	78%	0.781	S	S	*	*			trans	-52.3	118.5	168.9	-68	-94.3	0	0	0	111.2
791	S	26.5	Very low	26	Very low	89 Å²	89	135.6 Å²	135.6	62%	0.622	79%	0.786	S	S	*	*			trans	-118.9	89.7	162.8	175.3	0	0	0	0	108.8	G789 K793	G789-S791 PolarHBondContact O-N 2.77Å; S791-K793 VanDerWaalsContact C-N 3.35Å; S791-K793 PolarHBondContact O-N 2.92Å
792	I	24.4	Very low	25.8	Very low	161 Å²	161	131.6 Å²	131.6	83%	0.826	78%	0.783	S	S	*	*			trans	-69.8	92.6	167.9	-58.5	169.3	0	0	0	107
793	K	30.5	Very low	25.8	Very low	182 Å²	182	135.3 Å²	135.3	79%	0.791	79%	0.789	S	S	*	*			trans	-117.2	96.4	166.9	-77.3	-175.1	-178.9	177.7	0	109.6	S791	S791-K793 VanDerWaalsContact C-N 3.35Å; S791-K793 PolarHBondContact O-N 2.92Å
794	S	26.2	Very low	25.8	Very low	104 Å²	104	132.1 Å²	132.1	73%	0.727	79%	0.79	S	S	*	*			trans	32	105.9	135.8	-175.8	0	0	0	0	117.8
795	L	23.5	Very low	25.9	Very low	157 Å²	157	133.1 Å²	133.1	82%	0.822	80%	0.796	S	S	*	*				32.5	110.8	116.8	-149.3	86.9	0	0	0	116.8
796	K	30.2	Very low	26.1	Very low	200 Å²	200	138.1 Å²	138.1	87%	0.87	81%	0.805	S	S	*	*			trans	-163.7	114.9	141.3	-109.1	165.6	-173	-178.5	0	111.3
797	N	23.3	Very low	26.1	Very low	168 Å²	168	142.6 Å²	142.6	90%	0.898	81%	0.811	S	S	*	*			trans	-68.8	122	169.1	-77.5	-23.1	0	0	0	110.4
798	S	29.9	Very low	26.3	Very low	110 Å²	110	142.2 Å²	142.2	77%	0.769	81%	0.808	S	S	*	*			trans	-171.2	102.1	160.9	40.1	0	0	0	0	104.5
799	G	21.5	Very low	26.6	Very low	74 Å²	74	148 Å²	148	76%	0.763	81%	0.813	S	S	*	*				80.9	74.1	54.8	0	0	0	0	0	109
800	S	27.7	Very low	27.1	Very low	113 Å²	113	148.6 Å²	148.6	79%	0.79	81%	0.806	S	S	*	*			trans	168.2	124	144	36.4	0	0	0	0	113.2
801	N	25.9	Very low	27.7	Very low	147 Å²	147	148.1 Å²	148.1	79%	0.786	80%	0.804	S	S	*	*			trans	56.2	100.7	141.1	-64.5	-6.2	0	0	0	120.9
802	S	25.9	Very low	28.2	Very low	120 Å²	120	149.7 Å²	149.7	84%	0.839	81%	0.805	S	S	*	*				54	72.4	114.8	-47.1	0	0	0	0	117.2
803	Q	29	Very low	28.7	Very low	182 Å²	182	148 Å²	148	85%	0.85	80%	0.798	S	S	*	*			trans	-121.8	107.2	152	-147	145.9	5.9	0	0	109.3	C805	Q803-C805 PolarHBondContact O-N 2.93Å
804	S	26.6	Very low	29	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	79%	0.789	S	S	*	*			trans	-48.5	96.3	-180	-177.2	0	0	0	0	110.9	R806	S804-R806 PolarHBondContact O-N 3.29Å; S804-R806 VanDerWaalsContact O-N 3.12Å
805	C	27.6	Very low	29.6	Very low	119 Å²	119	142.2 Å²	142.2	80%	0.804	78%	0.781	S	S	*	*			trans	-70	106	167.6	-72.6	0	0	0	0	107	Q803 R807	Q803-C805 PolarHBondContact O-N 2.93Å; C805-R807 PolarHBondContact O-N 3.29Å
806	R	27.9	Very low	30.1	Very low	235 Å²	235	138.4 Å²	138.4	89%	0.887	77%	0.766	S	S	*	*			trans	-51.1	106.5	168.7	-70.2	-177.4	179.9	-175.1	0	107.7	S804 S808	S804-R806 PolarHBondContact O-N 3.29Å; S804-R806 VanDerWaalsContact O-N 3.12Å; R806-S808 PolarHBondContact O-N 2.85Å; R806-S808 VanDerWaalsContact O-N 3.11Å
807	R	26.8	Very low	30.6	Very low	243 Å²	243	134.2 Å²	134.2	92%	0.917	75%	0.752	S	S	*	*			trans	-65.3	110.9	-179.5	-145.2	170.5	173.1	152.2	-3.5	107.2	C805 K809	C805-R807 PolarHBondContact O-N 3.29Å; R807-K809 PolarHBondContact O-N 2.83Å
808	S	29.8	Very low	31.4	Very low	117 Å²	117	129.7 Å²	129.7	82%	0.818	73%	0.734	S	S	*	*			trans	-51.5	110.5	169.9	-54	0	0	0	0	107.8	R806 S810	R806-S808 PolarHBondContact O-N 2.85Å; R806-S808 VanDerWaalsContact O-N 3.11Å; S808-S810 PolarHBondContact O-N 3.49Å
809	K	31.1	Very low	31.6	Very low	189 Å²	189	133.8 Å²	133.8	82%	0.822	73%	0.732	S	S	*	*			trans	-66.3	105.3	179.2	-166.1	159.3	-178.7	163.6	0	106.3	R807 F811	R807-K809 PolarHBondContact O-N 2.83Å; K809-F811 PolarHBondContact O-N 2.98Å
810	S	32.7	Very low	32.4	Very low	86 Å²	86	135.4 Å²	135.4	60%	0.601	72%	0.723	S	S	*	*			trans	-52.5	127.4	168.6	46.2	0	0	0	0	107.4	S808 D812	S808-S810 PolarHBondContact O-N 3.49Å; S810-D812 PolarHBondContact O-N 3.39Å
811	F	35.5	Very low	33	Very low	199 Å²	199	134 Å²	134	87%	0.873	71%	0.707	S	S	*	*			trans	-63.2	103.8	171.7	-81	-93.9	0	0	0	107.1	K809 D813	K809-F811 PolarHBondContact O-N 2.98Å; F811-D813 PolarHBondContact O-N 3.37Å
812	D	35.7	Very low	33.4	Very low	122 Å²	122	136 Å²	136	65%	0.652	70%	0.703	S	S	*	*			trans	-68	112.2	169.8	-72.8	-40.3	0	0	0	107.8	S810 S814	S810-D812 PolarHBondContact O-N 3.39Å; D812-S814 PolarHBondContact O-N 3Å; D812-S814 PolarHBondContact O-OG 3.23Å
813	D	34.7	Very low	34	Very low	127 Å²	127	135 Å²	135	68%	0.679	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	12.7	176.6	-79.8	-32.7	0	0	0	115.1	F811 S815 C816	F811-D813 PolarHBondContact O-N 3.37Å; D813-S815 PolarHBondContact O-N 2.92Å; D813-C816 PolarHBondContact O-N 2.89Å
814	S	38	Very low	34.5	Very low	84 Å²	84	132.8 Å²	132.8	59%	0.587	68%	0.675	S	S	*	*	H	α-helix	trans	-64.4	-18.5	177.2	64.6	0	0	0	0	113.9	D812 S818	D812-S814 PolarHBondContact O-N 3Å; D812-S814 PolarHBondContact O-OG 3.23Å; S814-S818 PolarHBondContact O-OG 3.02Å
815	S	38.7	Very low	35.1	Very low	80 Å²	80	132.4 Å²	132.4	56%	0.559	66%	0.664	S	S	*	*	H	α-helix	trans	-68	-33.4	175	167	0	0	0	0	112.9	D813 S818	D813-S815 PolarHBondContact O-N 2.92Å; S815-S818 PolarHBondContact O-OG 2.89Å; S815-S818 VanDerWaalsContact O-OG 3.08Å
816	C	34.4	Very low	35.5	Very low	77 Å²	77	131.9 Å²	131.9	52%	0.52	65%	0.653	S	S	.	*	H	α-helix	trans	-76.6	-33.2	-176.5	-62.6	0	0	0	0	111.8	D813 L820	D813-C816 PolarHBondContact O-N 2.89Å; C816-L820 PolarHBondContact O-N 2.94Å
817	I	39.3	Very low	35.8	Very low	112 Å²	112	129.9 Å²	129.9	57%	0.574	65%	0.645	S	S	*	*	H	α-helix	trans	-71.7	-38.8	-179.3	-61	175.6	0	0	0	111.2	R819 L820 N821	I817-R819 VanDerWaalsContact C-N 3.34Å; I817-R819 PolarHBondContact O-N 3.45Å; I817-L820 PolarHBondContact O-N 2.96Å; I817-N821 PolarHBondContact O-N 3.35Å
818	S	41.4	Very low	36.4	Very low	73 Å²	73	124 Å²	124	51%	0.51	63%	0.631	S	S	.	*	H	α-helix	trans	-66.6	-34.5	177.8	45.8	0	0	0	0	112.5	S814 S815 R822	S814-S818 PolarHBondContact O-OG 3.02Å; S815-S818 PolarHBondContact O-OG 2.89Å; S815-S818 VanDerWaalsContact O-OG 3.08Å; S818-R822 PolarHBondContact O-N 2.86Å; S818-R822 VanDerWaalsContact O-N 3.09Å
819	R	33.2	Very low	36.4	Very low	195 Å²	195	127.2 Å²	127.2	74%	0.736	63%	0.627	S	S	*	*	H	α-helix	trans	-71	-37.3	177.2	-140.7	171.3	-178.9	168.8	-0.6	112.6	I817 R822 I823	I817-R819 VanDerWaalsContact C-N 3.34Å; I817-R819 PolarHBondContact O-N 3.45Å; R819-R822 PolarHBondContact O-N 3.38Å; R819-I823 WeakPolarHBondContact O-CG1 3.19Å; R819-I823 PolarHBondContact O-N 3.13Å
820	L	38.6	Very low	36.4	Very low	109 Å²	109	123.3 Å²	123.3	57%	0.571	62%	0.615	S	S	*	*	H	α-helix	trans	-68.6	-38.4	174.7	-100.6	151.4	0	0	0	112.7	C816 I817 I823 K824	C816-L820 PolarHBondContact O-N 2.94Å; I817-L820 PolarHBondContact O-N 2.96Å; L820-I823 PolarHBondContact O-N 3.04Å; L820-K824 PolarHBondContact O-N 3.22Å
821	N	40	Very low	36.6	Very low	84 Å²	84	121.8 Å²	121.8	45%	0.449	60%	0.604	S	S	.	*	H	α-helix	trans	-68.4	-34.6	175.3	-80	-18.2	0	0	0	112.5	I817 I823 K824 N825	I817-N821 PolarHBondContact O-N 3.35Å; N821-I823 VanDerWaalsContact C-N 3.28Å; N821-I823 PolarHBondContact O-N 3.01Å; N821-K824 PolarHBondContact O-N 2.97Å; N821-N825 PolarHBondContact O-N 3.01Å
822	R	34.1	Very low	36.5	Very low	189 Å²	189	116.4 Å²	116.4	71%	0.713	59%	0.585	S	S	*	*	H	α-helix	trans	-63.3	-35.1	173.1	-166.3	172.4	167.4	-176.4	-4.5	112.3	S818 R819 N826	S818-R822 PolarHBondContact O-N 2.86Å; S818-R822 VanDerWaalsContact O-N 3.09Å; R819-R822 PolarHBondContact O-N 3.38Å; R822-N826 PolarHBondContact O-N 3.06Å
823	I	39.7	Very low	36.4	Very low	97 Å²	97	115.3 Å²	115.3	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-72.3	-35.9	175.2	-63.3	166.5	0	0	0	111.4	R819 L820 N821 R827	R819-I823 WeakPolarHBondContact O-CG1 3.19Å; R819-I823 PolarHBondContact O-N 3.13Å; L820-I823 PolarHBondContact O-N 3.04Å; N821-I823 VanDerWaalsContact C-N 3.28Å; N821-I823 PolarHBondContact O-N 3.01Å; I823-R827 PolarHBondContact O-N 2.85Å
824	K	39.4	Very low	36.3	Very low	137 Å²	137	113.3 Å²	113.3	60%	0.596	57%	0.57	S	S	*	*	H	α-helix	trans	-66.5	-40.9	175.1	-79.1	-176	176	-179.8	0	112.2	L820 N821 N826 R827	L820-K824 PolarHBondContact O-N 3.22Å; N821-K824 PolarHBondContact O-N 2.97Å; K824-N826 PolarHBondContact O-N 3.05Å; K824-R827 PolarHBondContact O-N 3.09Å
825	N	39.4	Very low	36	Very low	107 Å²	107	117.5 Å²	117.5	57%	0.572	58%	0.578	S	S	*	*	H	α-helix	trans	-70.9	-32	-179.5	-70.2	-1.3	0	0	0	112.8	N821 R827 L828	N821-N825 PolarHBondContact O-N 3.01Å; N825-R827 VanDerWaalsContact C-N 3.26Å; N825-R827 PolarHBondContact O-N 3.08Å; N825-L828 PolarHBondContact O-N 3.14Å
826	N	35.7	Very low	35.6	Very low	107 Å²	107	123 Å²	123	57%	0.572	59%	0.586	S	S	*	*	H	α-helix	trans	-73	-15.3	173.7	-77.9	3.5	0	0	0	113.8	R822 K824	R822-N826 PolarHBondContact O-N 3.06Å; K824-N826 PolarHBondContact O-N 3.05Å
827	R	33.8	Very low	35.4	Very low	194 Å²	194	124 Å²	124	73%	0.732	59%	0.59	S	S	*	*	H	α-helix	trans	-81.2	-25.9	173.9	-80.3	-172.6	175	168.5	0.7	113.3	I823 K824 N825 Y829 N830	I823-R827 PolarHBondContact O-N 2.85Å; K824-R827 PolarHBondContact O-N 3.09Å; N825-R827 VanDerWaalsContact C-N 3.26Å; N825-R827 PolarHBondContact O-N 3.08Å; R827-Y829 VanDerWaalsContact C-N 3.28Å; R827-N830 PolarHBondContact O-N 3.04Å
828	L	38.5	Very low	35	Very low	119 Å²	119	128.9 Å²	128.9	62%	0.623	60%	0.601	S	S	*	*	H	α-helix	trans	-70.3	-26.6	173.7	-81.3	159.5	0	0	0	112	N825 N830 S831	N825-L828 PolarHBondContact O-N 3.14Å; L828-N830 VanDerWaalsContact C-N 3.28Å; L828-N830 PolarHBondContact O-N 3.25Å; L828-S831 PolarHBondContact O-OG 3.03Å; L828-S831 VanDerWaalsContact O-OG 3.11Å
829	Y	31.5	Very low	34.3	Very low	184 Å²	184	129 Å²	129	72%	0.722	61%	0.607	S	S	*	*	H	α-helix	trans	-73.1	-17.4	178	-127.8	-91	0	0	0	114.5	R827	R827-Y829 VanDerWaalsContact C-N 3.28Å
830	N	31.2	Very low	34.1	Very low	107 Å²	107	124.9 Å²	124.9	57%	0.572	61%	0.605	S	S	*	*	H	α-helix	trans	-96.7	-12.7	-178.7	-81.2	-35.3	0	0	0	114.3	R827 L828 V834	R827-N830 PolarHBondContact O-N 3.04Å; L828-N830 VanDerWaalsContact C-N 3.28Å; L828-N830 PolarHBondContact O-N 3.25Å; N830-V834 WeakPolarHBondContact O-CG2 3.49Å
831	S	35.3	Very low	33.5	Very low	54 Å²	54	127.6 Å²	127.6	38%	0.378	62%	0.62	S	S	.	*	H	α-helix	trans	-73.4	-29.7	174.3	45.3	0	0	0	0	112.8	L828 K835	L828-S831 PolarHBondContact O-OG 3.03Å; L828-S831 VanDerWaalsContact O-OG 3.11Å; S831-K835 PolarHBondContact O-N 3.05Å
832	D	33.3	Very low	32.9	Very low	86 Å²	86	128.4 Å²	128.4	46%	0.46	63%	0.628	S	S	.	*	H	α-helix	trans	-82.9	-31.1	-174.6	-66.4	-8.5	0	0	0	112.4	V834 K835 R836	D832-V834 VanDerWaalsContact C-N 3.31Å; D832-V834 PolarHBondContact O-N 3.24Å; D832-K835 PolarHBondContact O-N 3.19Å; D832-R836 PolarHBondContact O-N 3.1Å; D832-R836 VanDerWaalsContact O-N 3.12Å
833	I	33.8	Very low	32.6	Very low	99 Å²	99	125.5 Å²	125.5	51%	0.508	63%	0.631	S	S	.	*	H	α-helix	trans	-67.6	-36.2	174.3	-63.3	173.5	0	0	0	110.7	T837	I833-T837 PolarHBondContact O-OG1 2.93Å; I833-T837 VanDerWaalsContact O-OG1 3.11Å
834	V	32.8	Very low	32	Very low	85 Å²	85	126.7 Å²	126.7	52%	0.515	64%	0.638	S	S	.	*	H	α-helix	trans	-76.3	-29.1	178.2	-176.3	0	0	0	0	111.3	N830 D832 T837	N830-V834 WeakPolarHBondContact O-CG2 3.49Å; D832-V834 VanDerWaalsContact C-N 3.31Å; D832-V834 PolarHBondContact O-N 3.24Å; V834-T837 PolarHBondContact O-OG1 3.21Å
835	K	31.5	Very low	31.4	Very low	172 Å²	172	127.1 Å²	127.1	75%	0.748	65%	0.647	S	S	*	*	H	α-helix	trans	-72.2	-32.2	172.7	-77.8	-175	178.1	-179.5	0	113.3	S831 D832 T837	S831-K835 PolarHBondContact O-N 3.05Å; D832-K835 PolarHBondContact O-N 3.19Å; K835-T837 VanDerWaalsContact C-N 3.28Å; K835-T837 PolarHBondContact O-N 3.12Å
836	R	30	Very low	30.7	Very low	195 Å²	195	130.4 Å²	130.4	74%	0.736	66%	0.661	S	S	*	*	H	α-helix	trans	-71.8	-13.1	179.5	-78.5	-170.9	175.9	104.5	-6	115.3	D832	D832-R836 PolarHBondContact O-N 3.1Å; D832-R836 VanDerWaalsContact O-N 3.12Å
837	T	31.8	Very low	30.2	Very low	100 Å²	100	131.7 Å²	131.7	61%	0.613	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	1.6	-174.4	42	0	0	0	0	115.1	I833 V834 K835	I833-T837 PolarHBondContact O-OG1 2.93Å; I833-T837 VanDerWaalsContact O-OG1 3.11Å; V834-T837 PolarHBondContact O-OG1 3.21Å; K835-T837 VanDerWaalsContact C-N 3.28Å; K835-T837 PolarHBondContact O-N 3.12Å
838	W	29.2	Very low	29.8	Very low	213 Å²	213	127.5 Å²	127.5	81%	0.807	67%	0.673	S	S	*	*			trans	-100	15.2	-179.1	-72.3	65.5	0	0	0	114.4	P840	W838-P840 VanDerWaalsContact O-CD 3.29Å; W838-P840 WeakPolarHBondContact O-CD 3.42Å
839	A	26.7	Very low	29.2	Very low	76 Å²	76	132 Å²	132	63%	0.628	69%	0.688	S	S	*	*	S	Bend	trans	-76.6	114.8	160	0	0	0	0	0	107.2	L841	A839-L841 PolarHBondContact O-N 3.2Å
840	P	29	Very low	28.9	Very low	108 Å²	108	126.1 Å²	126.1	70%	0.701	68%	0.683	S	S	*	*			trans	-56.1	119.4	171.4	22.8	-29.9	0	0	0	106.9	W838 T842	W838-P840 VanDerWaalsContact O-CD 3.29Å; W838-P840 WeakPolarHBondContact O-CD 3.42Å; P840-T842 PolarHBondContact O-N 2.94Å
841	L	26.1	Very low	28.6	Very low	166 Å²	166	126.7 Å²	126.7	87%	0.869	70%	0.696	S	S	*	*			trans	-59.2	87.1	169.4	-73.6	166.3	0	0	0	106.9	A839 V843	A839-L841 PolarHBondContact O-N 3.2Å; L841-V843 VanDerWaalsContact C-N 3.32Å; L841-V843 PolarHBondContact O-N 3.31Å
842	T	27	Very low	28.4	Very low	101 Å²	101	129.3 Å²	129.3	62%	0.62	71%	0.711	S	S	*	*			trans	-66.9	103.8	165.2	48.4	0	0	0	0	104.7	P840 N844	P840-T842 PolarHBondContact O-N 2.94Å; T842-N844 PolarHBondContact O-N 3.22Å
843	V	29.6	Very low	28.3	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	73%	0.734	S	S	*	*			trans	-68.6	65.4	169.6	-171.1	0	0	0	0	107.5	L841	L841-V843 VanDerWaalsContact C-N 3.32Å; L841-V843 PolarHBondContact O-N 3.31Å
844	N	27.2	Very low	28.1	Very low	123 Å²	123	134.1 Å²	134.1	66%	0.658	75%	0.745	S	S	*	*			trans	-108	115.2	170.5	-71.3	-28.7	0	0	0	105	T842	T842-N844 PolarHBondContact O-N 3.22Å
845	N	26.4	Very low	27.9	Very low	146 Å²	146	136.2 Å²	136.2	78%	0.781	75%	0.752	S	S	*	*			trans	92.4	51.5	173.8	-48	-19.4	0	0	0	117.2
846	M	24.9	Very low	27.9	Very low	176 Å²	176	137.9 Å²	137.9	87%	0.867	76%	0.759	S	S	*	*			trans	-107.3	59.3	148.4	-86.2	-163.5	154.4	0	0	110.8
847	T	24.5	Very low	27.9	Very low	133 Å²	133	135.9 Å²	135.9	82%	0.816	76%	0.756	S	S	*	*			trans	-126	40.7	155.6	51.8	0	0	0	0	109.5
848	S	25.8	Very low	28.1	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	75%	0.751	S	S	*	*	S	Bend	trans	-106.1	120.7	167.6	-171.2	0	0	0	0	108.9	G850	S848-G850 PolarHBondContact O-N 3.48Å
849	F	26.4	Very low	28.8	Very low	215 Å²	215	129.5 Å²	129.5	94%	0.943	75%	0.746	S	S	*	*			trans	-56.3	112.1	177.4	-74.6	-102.7	0	0	0	110.6
850	G	25.2	Very low	29.5	Very low	59 Å²	59	131.9 Å²	131.9	61%	0.608	75%	0.748	S	S	*	*			trans	172.3	76.8	173.3	0	0	0	0	0	111	S848 P852	S848-G850 PolarHBondContact O-N 3.48Å; G850-P852 WeakPolarHBondContact O-CD 3.29Å
851	S	23.5	Very low	30	Very low	120 Å²	120	132 Å²	132	84%	0.839	74%	0.738	S	S	*	*			trans	-52.5	109.3	174.7	-61.8	0	0	0	0	110.8	K853	S851-K853 PolarHBondContact O-N 2.8Å; S851-K853 VanDerWaalsContact O-N 3.12Å
852	P	30.9	Very low	30.8	Very low	108 Å²	108	127.5 Å²	127.5	70%	0.701	73%	0.725	S	S	*	*			trans	-74	108.9	168.9	-5.4	24.7	0	0	0	106.2	G850 G854	G850-P852 WeakPolarHBondContact O-CD 3.29Å; P852-G854 PolarHBondContact O-N 2.79Å
853	K	31.2	Very low	31.5	Very low	214 Å²	214	130.8 Å²	130.8	93%	0.93	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.3	112.2	163.6	-70.3	173.2	176.3	173.6	0	107.6	S851	S851-K853 PolarHBondContact O-N 2.8Å; S851-K853 VanDerWaalsContact O-N 3.12Å
854	G	30.4	Very low	31.9	Very low	72 Å²	72	130.4 Å²	130.4	74%	0.742	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	154.8	-24	163.3	0	0	0	0	0	118.8	P852	P852-G854 PolarHBondContact O-N 2.79Å
855	I	28.7	Very low	32.7	Very low	129 Å²	129	128.7 Å²	128.7	66%	0.662	72%	0.716	S	S	*	*			trans	-105	91.3	-174.6	-47.6	177.8	0	0	0	109.7	F857	I855-F857 HydrophobicContact CB-CE2 4.19Å; I855-F857 HydrophobicContact CG2-CD2 3.8Å; I855-F857 HydrophobicContact CG2-CE1 4.5Å; I855-F857 HydrophobicContact CG2-CE2 3.42Å; I855-F857 VanDerWaalsContact CG2-CE2 3.42Å; I855-F857 HydrophobicContact CG2-CG 4.49Å; I855-F857 HydrophobicContact CG2-CZ 3.81Å; I855-F857 PolarHBondContact O-N 3.24Å; I855-F857 VanDerWaalsContact O-N 3.11Å
856	K	30.6	Very low	33.5	Very low	208 Å²	208	129.3 Å²	129.3	90%	0.904	72%	0.715	S	S	*	*			trans	-72.1	95.7	166.1	-81.1	-177.6	176.6	179.5	0	108.3
857	F	29.8	Very low	34	Very low	153 Å²	153	129.3 Å²	129.3	67%	0.671	71%	0.706	S	S	*	*			trans	-69.4	140.1	158.9	-72.6	-83	0	0	0	108.7	I855 S859	I855-F857 HydrophobicContact CB-CE2 4.19Å; I855-F857 HydrophobicContact CG2-CD2 3.8Å; I855-F857 HydrophobicContact CG2-CE1 4.5Å; I855-F857 HydrophobicContact CG2-CE2 3.42Å; I855-F857 VanDerWaalsContact CG2-CE2 3.42Å; I855-F857 HydrophobicContact CG2-CG 4.49Å; I855-F857 HydrophobicContact CG2-CZ 3.81Å; I855-F857 PolarHBondContact O-N 3.24Å; I855-F857 VanDerWaalsContact O-N 3.11Å; F857-S859 PolarHBondContact O-N 2.76Å
858	P	37.3	Very low	34.5	Very low	78 Å²	78	127.5 Å²	127.5	51%	0.506	69%	0.685	S	S	.	*			trans	-54.4	133.1	166.3	-19.2	30.7	0	0	0	108.9	D860 F861	P858-D860 PolarHBondContact O-N 3.17Å; P858-F861 HydrophobicContact CB-CD2 4.5Å; P858-F861 PolarHBondContact O-N 3.1Å
859	S	42.5	Very low	35.1	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	-21.9	-175.7	42.2	0	0	0	0	114.4	F857 F861 A862	F857-S859 PolarHBondContact O-N 2.76Å; S859-F861 PolarHBondContact O-N 3.02Å; S859-A862 PolarHBondContact O-N 2.88Å
860	D	42.6	Very low	35.6	Very low	125 Å²	125	127.4 Å²	127.4	67%	0.668	68%	0.681	S	S	*	*	H	α-helix	trans	-72	-15.1	-172.8	-49.7	-11.9	0	0	0	112.9	P858	P858-D860 PolarHBondContact O-N 3.17Å
861	F	38.6	Very low	36.2	Very low	112 Å²	112	126.7 Å²	126.7	49%	0.491	67%	0.666	S	S	.	*	H	α-helix	trans	-82.4	-24	179.9	-83.3	-83.2	0	0	0	114.4	P858 S859 V865	P858-F861 HydrophobicContact CB-CD2 4.5Å; P858-F861 PolarHBondContact O-N 3.1Å; S859-F861 PolarHBondContact O-N 3.02Å; F861-V865 VanDerWaalsContact O-CG2 3.32Å; F861-V865 WeakPolarHBondContact O-CG2 3.26Å; F861-V865 PolarHBondContact O-N 3.07Å
862	A	43.6	Very low	37	Very low	71 Å²	71	133 Å²	133	59%	0.587	67%	0.672	S	S	*	*	H	α-helix	trans	-70.9	-42.1	-173.2	0	0	0	0	0	112.1	S859 E866	S859-A862 PolarHBondContact O-N 2.88Å; A862-E866 PolarHBondContact O-N 2.89Å
863	E	42.2	Very low	37.4	Very low	170 Å²	170	133.3 Å²	133.3	79%	0.794	66%	0.664	S	S	*	*	H	α-helix	trans	-69.2	-36.9	178.4	-102.7	-177.5	162.5	0	0	112.5	V865 Y867	E863-V865 PolarHBondContact O-N 2.86Å; E863-Y867 PolarHBondContact O-N 3.16Å
864	E	37.8	Very low	37.8	Very low	119 Å²	119	127.6 Å²	127.6	56%	0.556	65%	0.651	S	S	*	*	H	α-helix	trans	-71.8	-31.3	-178.3	-131.1	179.3	-165.3	0	0	111.7	Y868	E864-Y868 HydrophobicContact CG-CD2 4.4Å; E864-Y868 HydrophobicContact CG-CE2 4.22Å; E864-Y868 VanDerWaalsContact O-CD2 3.27Å; E864-Y868 WeakPolarHBondContact O-CD2 3.31Å
865	V	43	Very low	38.5	Very low	87 Å²	87	128.2 Å²	128.2	53%	0.527	64%	0.644	S	S	.	*	H	α-helix	trans	-75.6	-37.8	178.6	177.5	0	0	0	0	112	F861 E863	F861-V865 VanDerWaalsContact O-CG2 3.32Å; F861-V865 WeakPolarHBondContact O-CG2 3.26Å; F861-V865 PolarHBondContact O-N 3.07Å; E863-V865 PolarHBondContact O-N 2.86Å
866	E	43.2	Very low	39.5	Very low	160 Å²	160	127 Å²	127	75%	0.748	64%	0.638	S	S	*	*	H	α-helix	trans	-70.4	-35.3	179	-84.7	-168.4	163.5	0	0	112.9	A862 Y868	A862-E866 PolarHBondContact O-N 2.89Å; E866-Y868 VanDerWaalsContact C-N 3.33Å; E866-Y868 PolarHBondContact O-N 2.74Å
867	Y	36.6	Very low	40	Very low	176 Å²	176	121.4 Å²	121.4	69%	0.69	62%	0.618	S	S	*	*	H	α-helix	trans	-68.2	-32.1	-179.5	-166.4	-97.5	0	0	0	112.9	E863	E863-Y867 PolarHBondContact O-N 3.16Å
868	Y	33.9	Very low	40.9	Very low	94 Å²	94	117.5 Å²	117.5	37%	0.369	61%	0.609	S	S	.	*	H	α-helix	trans	-101.3	-5.8	-169.4	-72.3	-77.5	0	0	0	115.9	E864 E866 N870 S871	E864-Y868 HydrophobicContact CG-CD2 4.4Å; E864-Y868 HydrophobicContact CG-CE2 4.22Å; E864-Y868 VanDerWaalsContact O-CD2 3.27Å; E864-Y868 WeakPolarHBondContact O-CD2 3.31Å; E866-Y868 VanDerWaalsContact C-N 3.33Å; E866-Y868 PolarHBondContact O-N 2.74Å; Y868-N870 PolarHBondContact O-N 3.03Å; Y868-N870 VanDerWaalsContact O-N 3.16Å; Y868-S871 PolarHBondContact O-N 2.93Å
869	Q	38.6	Very low	41.5	Very low	163 Å²	163	119 Å²	119	76%	0.762	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-22.7	170.4	-90.9	-170.9	-0.3	0	0	113.2
870	N	38.4	Very low	41.8	Very low	157 Å²	157	122.5 Å²	122.5	84%	0.84	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	1.8	-179.8	-69.6	-32.1	0	0	0	114.5	Y868	Y868-N870 PolarHBondContact O-N 3.03Å; Y868-N870 VanDerWaalsContact O-N 3.16Å
871	S	36	Very low	42.2	Very low	43 Å²	43	121.3 Å²	121.3	30%	0.301	60%	0.604	S	S	.	*	S	Bend	trans	-106.2	137.2	179.6	-177	0	0	0	0	111.9	Y868 E873	Y868-S871 PolarHBondContact O-N 2.93Å; S871-E873 PolarHBondContact O-N 2.89Å
872	R	41.2	Very low	42.7	Very low	253 Å²	253	119.9 Å²	119.9	96%	0.955	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	1.2	176	-100.6	178.2	169.7	-179.8	-3.4	114.6
873	E	39.6	Very low	43	Very low	115 Å²	115	119.1 Å²	119.1	54%	0.537	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.3	10.1	-173.7	-65.2	-177.7	161.1	0	0	114.3	S871 S875 L876	S871-E873 PolarHBondContact O-N 2.89Å; E873-S875 PolarHBondContact O-N 2.71Å; E873-L876 WeakPolarHBondContact O-CB 3.33Å; E873-L876 PolarHBondContact O-N 2.78Å
874	S	39.8	Very low	43.3	Very low	93 Å²	93	119.5 Å²	119.5	65%	0.65	59%	0.587	S	S	*	*	H	α-helix	trans	-53.9	-25.4	-177.2	58	0	0	0	0	115.1	S878	S874-S878 PolarHBondContact O-N 2.84Å
875	S	45.5	Very low	43.9	Very low	85 Å²	85	119 Å²	119	59%	0.594	59%	0.587	S	S	*	*	H	α-helix	trans	-67.5	-33.5	175.1	73.8	0	0	0	0	113.7	E873 L877 S878 D879	E873-S875 PolarHBondContact O-N 2.71Å; S875-L877 VanDerWaalsContact C-N 3.33Å; S875-L877 PolarHBondContact O-N 2.81Å; S875-S878 PolarHBondContact O-N 3.11Å; S875-D879 PolarHBondContact O-N 3.32Å
876	L	48.8	Very low	44.1	Very low	104 Å²	104	122 Å²	122	55%	0.545	59%	0.588	S	S	.	*	H	α-helix	trans	-70.9	-31.4	-173.9	-123.7	160.9	0	0	0	111.9	E873 R880	E873-L876 WeakPolarHBondContact O-CB 3.33Å; E873-L876 PolarHBondContact O-N 2.78Å; L876-R880 PolarHBondContact O-N 2.89Å
877	L	40.2	Very low	44.2	Very low	91 Å²	91	117.7 Å²	117.7	48%	0.476	58%	0.581	S	S	.	*	H	α-helix	trans	-79.9	-32.4	175.4	-91.9	162.8	0	0	0	113	S875 D879 R880 L881	S875-L877 VanDerWaalsContact C-N 3.33Å; S875-L877 PolarHBondContact O-N 2.81Å; L877-D879 VanDerWaalsContact C-N 3.28Å; L877-D879 PolarHBondContact O-N 2.84Å; L877-R880 PolarHBondContact O-N 2.73Å; L877-L881 VanDerWaalsContact O-CB 3.24Å; L877-L881 WeakPolarHBondContact O-CB 3.37Å; L877-L881 PolarHBondContact O-N 2.78Å
878	S	50.2	Low	44.8	Very low	70 Å²	70	118.5 Å²	118.5	49%	0.49	58%	0.582	S	S	.	*	H	α-helix	trans	-58	-45.8	174.9	-163.3	0	0	0	0	110.2	S874 S875 L881 E882	S874-S878 PolarHBondContact O-N 2.84Å; S875-S878 PolarHBondContact O-N 3.11Å; S878-L881 PolarHBondContact O-N 2.98Å; S878-E882 VanDerWaalsContact O-CB 3.23Å; S878-E882 WeakPolarHBondContact O-CB 3.23Å; S878-E882 PolarHBondContact O-N 2.74Å
879	D	49.6	Very low	45.3	Very low	109 Å²	109	116.6 Å²	116.6	58%	0.583	59%	0.591	S	S	*	*	H	α-helix	trans	-67.1	-40.7	179.5	-73.3	-11	0	0	0	112.2	S875 L877 A883	S875-D879 PolarHBondContact O-N 3.32Å; L877-D879 VanDerWaalsContact C-N 3.28Å; L877-D879 PolarHBondContact O-N 2.84Å; D879-A883 VanDerWaalsContact O-CB 3.22Å; D879-A883 WeakPolarHBondContact O-CB 3.4Å; D879-A883 PolarHBondContact O-N 3.04Å
880	R	48.9	Very low	45.4	Very low	176 Å²	176	117.3 Å²	117.3	66%	0.664	59%	0.594	S	S	*	*	H	α-helix	trans	-69.2	-39.3	177.7	-76.3	-176	98.3	155.2	4.1	112.5	L876 L877 R884	L876-R880 PolarHBondContact O-N 2.89Å; L877-R880 PolarHBondContact O-N 2.73Å; R880-R884 WeakPolarHBondContact O-CB 3.46Å; R880-R884 PolarHBondContact O-N 3.15Å
881	L	49.7	Very low	45.4	Very low	100 Å²	100	113.8 Å²	113.8	52%	0.524	58%	0.582	S	S	.	*	H	α-helix	trans	-67.6	-44.5	176.9	-172.2	67.8	0	0	0	110	L877 S878 A883 R884 I885	L877-L881 VanDerWaalsContact O-CB 3.24Å; L877-L881 WeakPolarHBondContact O-CB 3.37Å; L877-L881 PolarHBondContact O-N 2.78Å; S878-L881 PolarHBondContact O-N 2.98Å; L881-A883 VanDerWaalsContact C-N 3.34Å; L881-A883 PolarHBondContact O-N 2.95Å; L881-R884 PolarHBondContact O-N 2.85Å; L881-R884 VanDerWaalsContact O-N 3.13Å; L881-I885 HydrophobicContact CG-CD1 3.99Å; L881-I885 VanDerWaalsContact O-CG1 3.29Å; L881-I885 WeakPolarHBondContact O-CG1 3.38Å; L881-I885 PolarHBondContact O-N 3Å
882	E	49.7	Very low	45.2	Very low	82 Å²	82	120.3 Å²	120.3	38%	0.383	61%	0.605	S	S	.	*	H	α-helix	trans	-63.9	-38.6	176.5	-160	-177.5	146.5	0	0	111.8	S878 I885 R886	S878-E882 VanDerWaalsContact O-CB 3.23Å; S878-E882 WeakPolarHBondContact O-CB 3.23Å; S878-E882 PolarHBondContact O-N 2.74Å; E882-I885 PolarHBondContact O-N 2.79Å; E882-R886 WeakPolarHBondContact O-CB 3.39Å; E882-R886 PolarHBondContact O-N 2.95Å; E882-R886 IonicContact OE1-CZ 3.17Å; E882-R886 IonicContact OE1-NH1 3.34Å; E882-R886 PolarHBondContact OE1-NH1 3.5Å; E882-R886 IonicContact OE1-NH2 3.01Å; E882-R886 PolarHBondContact OE1-NH2 3.1Å; E882-R886 IonicContact OE2-NH2 3.01Å
883	A	51.2	Low	45	Very low	55 Å²	55	115.9 Å²	115.9	46%	0.455	60%	0.6	S	S	.	*	H	α-helix	trans	-64	-39.5	172.1	0	0	0	0	0	112.3	D879 L881 A887	D879-A883 VanDerWaalsContact O-CB 3.22Å; D879-A883 WeakPolarHBondContact O-CB 3.4Å; D879-A883 PolarHBondContact O-N 3.04Å; L881-A883 VanDerWaalsContact C-N 3.34Å; L881-A883 PolarHBondContact O-N 2.95Å; A883-A887 WeakPolarHBondContact O-CB 3.16Å; A883-A887 PolarHBondContact O-N 3.11Å
884	R	47	Very low	44.5	Very low	178 Å²	178	117.5 Å²	117.5	67%	0.672	62%	0.618	S	S	*	*	H	α-helix	trans	-70.1	-38.3	176	-100.5	-177.3	-179.2	154.2	-1.3	112.8	R880 L881 A887 R888	R880-R884 WeakPolarHBondContact O-CB 3.46Å; R880-R884 PolarHBondContact O-N 3.15Å; L881-R884 PolarHBondContact O-N 2.85Å; L881-R884 VanDerWaalsContact O-N 3.13Å; R884-A887 PolarHBondContact O-N 3.3Å; R884-R888 PolarHBondContact O-N 2.89Å
885	I	50.1	Low	44.3	Very low	109 Å²	109	122.3 Å²	122.3	56%	0.559	65%	0.651	S	S	*	*	H	α-helix	trans	-64.5	-45.4	174.7	-67.7	166.5	0	0	0	109.3	L881 E882 A887 R888 G889	L881-I885 HydrophobicContact CG-CD1 3.99Å; L881-I885 VanDerWaalsContact O-CG1 3.29Å; L881-I885 WeakPolarHBondContact O-CG1 3.38Å; L881-I885 PolarHBondContact O-N 3Å; E882-I885 PolarHBondContact O-N 2.79Å; I885-A887 VanDerWaalsContact C-N 3.34Å; I885-A887 PolarHBondContact O-N 3.02Å; I885-R888 PolarHBondContact O-N 3.37Å; I885-G889 PolarHBondContact O-N 3.01Å
886	R	47.3	Very low	44.2	Very low	148 Å²	148	124.2 Å²	124.2	56%	0.558	65%	0.654	S	S	*	*	H	α-helix	trans	-60	-41.1	173.4	-82.5	-170.1	-87.5	-114.1	-1.6	112.6	E882 G889	E882-R886 WeakPolarHBondContact O-CB 3.39Å; E882-R886 PolarHBondContact O-N 2.95Å; E882-R886 IonicContact OE1-CZ 3.17Å; E882-R886 IonicContact OE1-NH1 3.34Å; E882-R886 PolarHBondContact OE1-NH1 3.5Å; E882-R886 IonicContact OE1-NH2 3.01Å; E882-R886 PolarHBondContact OE1-NH2 3.1Å; E882-R886 IonicContact OE2-NH2 3.01Å; R886-G889 PolarHBondContact O-N 3.41Å
887	A	46.8	Very low	44	Very low	71 Å²	71	125.2 Å²	125.2	59%	0.587	66%	0.66	S	S	*	*	H	α-helix	trans	-66.3	-37	177.7	0	0	0	0	0	112.8	A883 R884 I885	A883-A887 WeakPolarHBondContact O-CB 3.16Å; A883-A887 PolarHBondContact O-N 3.11Å; R884-A887 PolarHBondContact O-N 3.3Å; I885-A887 VanDerWaalsContact C-N 3.34Å; I885-A887 PolarHBondContact O-N 3.02Å
888	R	47.7	Very low	44.2	Very low	193 Å²	193	127.1 Å²	127.1	73%	0.728	67%	0.67	S	S	*	*	H	α-helix	trans	-79	-26.6	175	-76.2	-169.3	175.8	-153.8	0.4	113.6	R884 I885 H890 S891	R884-R888 PolarHBondContact O-N 2.89Å; I885-R888 PolarHBondContact O-N 3.37Å; R888-H890 PolarHBondContact O-N 2.86Å; R888-H890 VanDerWaalsContact O-N 3.14Å; R888-S891 PolarHBondContact O-N 2.95Å; R888-S891 PolarHBondContact O-OG 3.14Å
889	G	44.7	Very low	43.9	Very low	54 Å²	54	130.5 Å²	130.5	56%	0.557	68%	0.681	S	S	*	*	H	α-helix	trans	-60.9	-19.6	174.8	0	0	0	0	0	113.5	I885 R886	I885-G889 PolarHBondContact O-N 3.01Å; R886-G889 PolarHBondContact O-N 3.41Å
890	H	41.4	Very low	43.5	Very low	177 Å²	177	131.8 Å²	131.8	82%	0.819	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	0.7	175.8	-73.5	-43.6	0	0	0	115	R888	R888-H890 PolarHBondContact O-N 2.86Å; R888-H890 VanDerWaalsContact O-N 3.14Å
891	S	37.2	Very low	43.1	Very low	84 Å²	84	128.9 Å²	128.9	59%	0.587	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	6.3	177.6	66	0	0	0	0	114.7	R888	R888-S891 PolarHBondContact O-N 2.95Å; R888-S891 PolarHBondContact O-OG 3.14Å
892	F	33.7	Very low	42.7	Very low	179 Å²	179	130.9 Å²	130.9	79%	0.785	70%	0.7	S	S	*	*			trans	-111.5	71.1	173.6	-78.8	-84	0	0	0	110
893	D	36.2	Very low	42.1	Very low	160 Å²	160	134.7 Å²	134.7	86%	0.856	73%	0.725	S	S	*	*			trans	-164.4	57.7	162.2	-94.8	-26.5	0	0	0	108.8
894	V	29.9	Very low	41.4	Very low	149 Å²	149	141.3 Å²	141.3	90%	0.903	75%	0.747	S	S	*	*			trans	-143.1	84.3	162.5	-171.8	0	0	0	0	107.7
895	S	34.5	Very low	40.9	Very low	194 Å²	194	138 Å²	138	100%	1.357	75%	0.754	S	S	*	*			trans	-148.1	0	159.2	65.7	0	0	0	0	109.6

Retrieved 895 of 895 residues in 271.6 ms (Link to these results)

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