A0A077Z0N9_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0N9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,013 aa.

						>A0A077Z0N9_TRITR|A0A077Z0N9
MSKGKMTLPSDPSSRVDIHESTELATANSSYAFRPKGSSGPTQVYPRPGGTETESKISLRGPSSGENELTGKLCIGDGFKMSSREQVENNAQLEKQDHRQGIAGEENLNFGTQPYIGQPAKDQIVVTKTASESTTLTPTSLRDSSEQENELNALKDYPSSESESISLRLLNFDKKDEIGTPEAGDMKEAAELDANADFPEEKLMDLANEEIEQKDATGLAGEPKAQEAQGTHSKFRNANGTKNILGSDDQFLNKCVPPEDENGELNHLNEFRGRQQEEVMANYKYNCIEPQGWPDDERAVLGGNAQDKHETGEDFTRQMLLAYLKDSMTKWLDKVKRIKRSYPGEKMPSKRPKLRKRAASYNYIWNTEEESDNRGIPMKMIIEQWRNRFAKGLNEEIGEIKSSRREPRGRSRSCGSICMGRTEATDIEDRKAVQKNRNKTPPQAQSISPSLHNIEKANLVEGGQKVLKMADGSQKAQQPQTTATPKPPVAALVPDLQRSKVPKQPGGTGQTVEVKKHFPANAKPEGIKQVKTKPEPGHVLQKETESKERLLAALAQGLIKLHRKALELEKIKQEQMQLQMQKMQQKCETPKSGSPGKVAEKHQLKDDAVKRLADANQLKPKMKAEKQTSDSAKGRHHRQHSPKTSSGGKGIQPNIHKDNIRANRKEQSPILRAKPTRHHLEKGRRDRSPYHSPIASPRVSHHRHGRHGHHKLNRKTRKSSGRKPHHHRLSPARKHAKAKKSRSGRKAEKHHRKDRKTTPERSGKQLSNKHREKRKRDKARLQEHKVHPEKPAGRHHLRREQEPSQQRPKGKHTTPKDHEEQRSPKWKARAGSKEEAKVQAKKGSNKSDSDHRLRSPEKPGKIQSPTLTRKDATKPLKEQALQQPQTPKNLLRSPRKLSKEKNQREKKDVTKSPMTSKKDNSGGLKTPKAKMENVQAGKRDASRSPVISKMDENSAFDLTKAIMEKKKTTKKNTGKLPVISKSEEGSFKKAGVPKEKNPKEKRNITKNDLAKRK
					

Structure Viewer

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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	34.1	Very low	36.8	Very low	236 Å²	236	149.8 Å²	149.8	100%	1.163	83%	0.83	S	S	*	*				0	155.3	0	-58.7	-168.2	90	0	0	108.6
2	S	39.8	Very low	37.5	Very low	88 Å²	88	147.1 Å²	147.1	62%	0.615	83%	0.825	S	S	*	*			cis	152.3	126	-39	55.8	0	0	0	0	110.5
3	K	35.8	Very low	37.5	Very low	218 Å²	218	143.2 Å²	143.2	95%	0.948	81%	0.813	S	S	*	*			trans	76.3	159.2	162.7	-58.1	176	178	176.6	0	118.9
4	G	39.2	Very low	37.9	Very low	72 Å²	72	140.5 Å²	140.5	74%	0.742	81%	0.808	S	S	*	*			trans	99.8	100.6	-178	0	0	0	0	0	112.2
5	K	33.4	Very low	37.6	Very low	206 Å²	206	145.6 Å²	145.6	90%	0.896	81%	0.808	S	S	*	*			cis	74.8	101.7	13.2	-128.9	-163.1	-171.5	-162.9	0	115.5
6	M	39	Very low	37.6	Very low	177 Å²	177	145.4 Å²	145.4	87%	0.872	81%	0.812	S	S	*	*			trans	174.5	161	156.6	-91	-79.4	-70.2	0	0	107.2
7	T	34	Very low	37.3	Very low	115 Å²	115	143.2 Å²	143.2	71%	0.706	80%	0.798	S	S	*	*				-149.9	160.8	-53.2	-76.7	0	0	0	0	108
8	L	32	Very low	36.8	Very low	156 Å²	156	143.2 Å²	143.2	82%	0.817	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-73.6	148.1	-175.3	-68	161.3	0	0	0	114.5
9	P	48.7	Very low	36.6	Very low	122 Å²	122	145.4 Å²	145.4	79%	0.792	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-85	157.9	149.9	35.8	-31.5	0	0	0	111.5
10	S	37.7	Very low	36.4	Very low	125 Å²	125	147.6 Å²	147.6	87%	0.874	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-101.5	164.7	-170.6	-59.2	0	0	0	0	115.3
11	D	30.8	Very low	36.1	Very low	133 Å²	133	146 Å²	146	71%	0.711	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-73.7	138.9	-177.6	173.4	47	0	0	0	115.1	S13	D11-S13 PolarHBondContact OD1-N 2.72Å; D11-S13 WeakPolarHBondContact OD2-CB 3.36Å; D11-S13 PolarHBondContact OD2-N 3.02Å
12	P	45.5	Very low	36	Very low	117 Å²	117	140.4 Å²	140.4	76%	0.76	78%	0.781	S	S	*	*			trans	-108.4	81.6	160.1	37.2	-26.6	0	0	0	112.3	S14	P12-S14 PolarHBondContact O-N 3.25Å
13	S	38	Very low	35.4	Very low	97 Å²	97	145.3 Å²	145.3	68%	0.678	79%	0.794	S	S	*	*			trans	-61.8	122.8	171.7	137	0	0	0	0	113	D11	D11-S13 PolarHBondContact OD1-N 2.72Å; D11-S13 WeakPolarHBondContact OD2-CB 3.36Å; D11-S13 PolarHBondContact OD2-N 3.02Å
14	S	42.7	Very low	35.4	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	79%	0.786	S	S	*	*			trans	-156.5	71.3	156.7	53.9	0	0	0	0	114.7	P12 V16	P12-S14 PolarHBondContact O-N 3.25Å; S14-V16 PolarHBondContact O-N 2.67Å
15	R	33.7	Very low	34.9	Very low	217 Å²	217	142.3 Å²	142.3	82%	0.819	78%	0.783	S	S	*	*			trans	22.8	97.6	139.4	-169.9	-175	-169.6	169.2	3.8	117.7	D17	R15-D17 IonicContact NE-OD2 3.5Å; R15-D17 PolarHBondContact NE-OD2 3.11Å
16	V	37	Very low	34.9	Very low	142 Å²	142	138.4 Å²	138.4	86%	0.861	78%	0.776	S	S	*	*			trans	-126.4	119.5	143.9	179.4	0	0	0	0	106.9	S14	S14-V16 PolarHBondContact O-N 2.67Å
17	D	32.8	Very low	34.4	Very low	109 Å²	109	134 Å²	134	58%	0.583	77%	0.767	S	S	*	*			trans	-80.3	137.2	-174.1	-77.3	-66.5	0	0	0	112	R15	R15-D17 IonicContact NE-OD2 3.5Å; R15-D17 PolarHBondContact NE-OD2 3.11Å
18	I	28.1	Very low	34.3	Very low	143 Å²	143	136 Å²	136	73%	0.733	77%	0.774	S	S	*	*			trans	58.1	101.4	158.4	-51.7	159.3	0	0	0	116.3
19	H	32.9	Very low	34.3	Very low	185 Å²	185	133.4 Å²	133.4	86%	0.856	77%	0.769	S	S	*	*				-152.7	128.8	121.2	-106.2	-68.8	0	0	0	111	S21	H19-S21 PolarHBondContact O-N 3.46Å
20	E	33.6	Very low	33.6	Very low	188 Å²	188	132.7 Å²	132.7	88%	0.879	77%	0.767	S	S	*	*			trans	-75.7	115.8	-175.7	-174	176.1	-166	0	0	110.8
21	S	30.2	Very low	33.2	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	76%	0.755	S	S	*	*			trans	-160.5	96.1	175.4	-79.3	0	0	0	0	111.1	H19	H19-S21 PolarHBondContact O-N 3.46Å
22	T	30.6	Very low	33.2	Very low	120 Å²	120	131.4 Å²	131.4	74%	0.736	75%	0.749	S	S	*	*			trans	-133.9	86.9	171	-38.7	0	0	0	0	109.6	L24	T22-L24 HydrophobicContact CG2-CG 4.47Å; T22-L24 PolarHBondContact O-N 3.21Å
23	E	28.5	Very low	32.5	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	74%	0.742	S	S	*	*			trans	-61.4	104.8	161.3	-68	-171.9	142.6	0	0	108.2	A25	E23-A25 PolarHBondContact O-N 3.43Å
24	L	34	Very low	32.3	Very low	146 Å²	146	135.3 Å²	135.3	76%	0.764	74%	0.738	S	S	*	*			trans	-76.4	68.3	171.3	-90.5	170.9	0	0	0	110.6	T22 T26	T22-L24 HydrophobicContact CG2-CG 4.47Å; T22-L24 PolarHBondContact O-N 3.21Å; L24-T26 PolarHBondContact O-N 3.4Å
25	A	30	Very low	32.1	Very low	82 Å²	82	134.4 Å²	134.4	68%	0.678	73%	0.73	S	S	*	*			trans	-69.6	78.1	164.8	0	0	0	0	0	109.5	E23 A27	E23-A25 PolarHBondContact O-N 3.43Å; A25-A27 PolarHBondContact O-N 3.42Å
26	T	32.3	Very low	31.9	Very low	123 Å²	123	129.6 Å²	129.6	76%	0.755	72%	0.715	S	S	*	*			trans	-71.1	74.5	172	50.7	0	0	0	0	110.9	L24 N28	L24-T26 PolarHBondContact O-N 3.4Å; T26-N28 PolarHBondContact O-N 3.48Å
27	A	30.4	Very low	31.6	Very low	84 Å²	84	126.2 Å²	126.2	69%	0.694	71%	0.709	S	S	*	*			trans	-74.9	103.7	168.1	0	0	0	0	0	109.8	A25	A25-A27 PolarHBondContact O-N 3.42Å
28	N	31.5	Very low	31.8	Very low	158 Å²	158	126.8 Å²	126.8	85%	0.845	72%	0.721	S	S	*	*			trans	-117.7	92	152.7	-91.6	-43.9	0	0	0	106.6	T26	T26-N28 PolarHBondContact O-N 3.48Å
29	S	31.3	Very low	32.3	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	73%	0.73	S	S	*	*				81.4	135.7	65.2	-168.3	0	0	0	0	111.8
30	S	34.2	Very low	32.1	Very low	108 Å²	108	120.9 Å²	120.9	76%	0.755	72%	0.724	S	S	*	*			trans	-65.8	137.7	-166.6	51.2	0	0	0	0	113.7
31	Y	29.8	Very low	32.2	Very low	160 Å²	160	117.7 Å²	117.7	63%	0.627	72%	0.72	S	S	*	*			trans	-112	107.6	157.6	-161.6	-83.5	0	0	0	110.5	Q478	Y31-Q478 WeakPolarHBondContact OH-CA 3.34Å; Y31-Q478 VanDerWaalsContact OH-CB 3.23Å; Y31-Q478 WeakPolarHBondContact OH-CB 3.14Å; Y31-Q478 PolarHBondContact OH-N 3.44Å
32	A	30.7	Very low	32.3	Very low	71 Å²	71	119 Å²	119	59%	0.587	72%	0.723	S	S	*	*			trans	-146.7	130.5	176.5	0	0	0	0	0	109.5
33	F	31.2	Very low	32.2	Very low	139 Å²	139	120.4 Å²	120.4	61%	0.61	72%	0.722	S	S	*	*			trans	-174.9	144	138.9	-109.3	-70.7	0	0	0	114.5	Q474 A476	F33-Q474 WeakPolarHBondContact CE1-O 3.32Å; F33-A476 VanDerWaalsContact CB-N 3.34Å; F33-A476 WeakPolarHBondContact CB-O 3.46Å; F33-A476 WeakPolarHBondContact CD2-O 3.4Å; F33-A476 WeakPolarHBondContact CG-O 3.5Å
34	R	33.1	Very low	32.4	Very low	157 Å²	157	118.2 Å²	118.2	59%	0.592	72%	0.721	S	S	*	*			trans	-54.8	166.4	177.9	-48.8	167	174.8	-108.4	12.2	114.6	K475	R34-K475 WeakPolarHBondContact O-CA 3.18Å
35	P	38.1	Very low	32.1	Very low	86 Å²	86	120.7 Å²	120.7	56%	0.558	72%	0.722	S	S	*	*				-156.6	160.1	86.5	40.6	-21.3	0	0	0	121.2	Q474 K475	P35-Q474 HydrophobicContact CB-CG 3.61Å; P35-K475 HydrophobicContact CB-CG 4.02Å; P35-K475 HydrophobicContact CG-CG 4.15Å
36	K	29.1	Very low	32.4	Very low	116 Å²	116	122.5 Å²	122.5	50%	0.504	73%	0.726	S	S	.	*			trans	0.8	138.8	153.8	-70.8	-178.9	-168.2	168	0	123.3	S473 Q474	K36-S473 VanDerWaalsContact CE-C 3.48Å; K36-S473 VanDerWaalsContact CE-O 3.25Å; K36-S473 WeakPolarHBondContact CE-O 3.41Å; K36-S473 WeakPolarHBondContact CE-OG 2.96Å; K36-S473 WeakPolarHBondContact CG-OG 3.33Å; K36-S473 PolarHBondContact NZ-O 3.35Å; K36-Q474 HydrophobicContact CB-CG 4.46Å; K36-Q474 HydrophobicContact CD-CB 4.44Å; K36-Q474 HydrophobicContact CD-CG 3.76Å; K36-Q474 HydrophobicContact CG-CG 4.02Å
37	G	32.1	Very low	32.4	Very low	71 Å²	71	128.4 Å²	128.4	73%	0.732	74%	0.735	S	S	*	*				168.6	154.7	129	0	0	0	0	0	113.8
38	S	36.3	Very low	32.7	Very low	120 Å²	120	130.6 Å²	130.6	84%	0.839	74%	0.742	S	S	*	*			cis	-176.6	114.1	-39.2	44.2	0	0	0	0	112.4
39	S	37.8	Very low	32.8	Very low	132 Å²	132	127 Å²	127	92%	0.923	74%	0.743	S	S	*	*			trans	-176.3	142.3	158.2	52.4	0	0	0	0	109.7
40	G	29.6	Very low	32.7	Very low	72 Å²	72	125.5 Å²	125.5	74%	0.742	74%	0.743	S	S	*	*			cis	-148.3	-171.8	-4.2	0	0	0	0	0	111.9
41	P	34.7	Very low	32.5	Very low	122 Å²	122	125.8 Å²	125.8	79%	0.792	74%	0.74	S	S	*	*			trans	-110.1	167.9	-158	40.3	-35.6	0	0	0	116.2
42	T	32.7	Very low	32.5	Very low	140 Å²	140	126.6 Å²	126.6	86%	0.859	75%	0.75	S	S	*	*			trans	-156.2	138.5	141.4	-65.2	0	0	0	0	108.9
43	Q	28.8	Very low	32.6	Very low	150 Å²	150	129.2 Å²	129.2	70%	0.701	76%	0.759	S	S	*	*			trans	-95.2	151.2	179.2	-63.6	171.7	-19.5	0	0	112
44	V	32.7	Very low	32.4	Very low	145 Å²	145	130.9 Å²	130.9	88%	0.879	77%	0.768	S	S	*	*			trans	-140.8	146.4	151.5	-175.4	0	0	0	0	108
45	Y	27.5	Very low	32.2	Very low	197 Å²	197	127.7 Å²	127.7	77%	0.773	77%	0.77	S	S	*	*			trans	-85.5	159.4	-165.6	-80.7	-105.4	0	0	0	115.1
46	P	36.5	Very low	31.9	Very low	120 Å²	120	132 Å²	132	78%	0.779	78%	0.78	S	S	*	*			trans	-92.3	169	-178.1	38	-37	0	0	0	114.3
47	R	32.1	Very low	31.9	Very low	247 Å²	247	134 Å²	134	93%	0.932	80%	0.795	S	S	*	*			trans	-148	146.2	158.3	-140.1	167.9	-174.1	177.8	1.6	110.5
48	P	37.4	Very low	31.7	Very low	130 Å²	130	136.1 Å²	136.1	84%	0.844	80%	0.798	S	S	*	*			trans	-113.7	171.7	-160.3	41.4	-33	0	0	0	116
49	G	32.3	Very low	31.4	Very low	84 Å²	84	138.3 Å²	138.3	87%	0.866	80%	0.799	S	S	*	*			trans	123.3	129.1	169.7	0	0	0	0	0	113.1
50	G	30.3	Very low	30.9	Very low	68 Å²	68	143.5 Å²	143.5	70%	0.701	80%	0.799	S	S	*	*			cis	-174.6	165.3	-6.9	0	0	0	0	0	112.6
51	T	30.1	Very low	31.2	Very low	114 Å²	114	143.7 Å²	143.7	70%	0.699	80%	0.8	S	S	*	*			trans	33.3	113.1	148.2	54.6	0	0	0	0	119
52	E	29.4	Very low	31.1	Very low	178 Å²	178	143.2 Å²	143.2	83%	0.832	80%	0.797	S	S	*	*				77.4	154.9	97.3	-68.3	160.5	-144.2	0	0	113.7
53	T	32.9	Very low	30.9	Very low	126 Å²	126	141.1 Å²	141.1	77%	0.773	79%	0.788	S	S	*	*			cis	-131.1	164.8	13.7	53.4	0	0	0	0	114.3
54	E	26.8	Very low	30.8	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	80%	0.798	S	S	*	*			trans	-34.4	151.4	161.9	-40	176.6	143.7	0	0	118.3
55	S	30	Very low	30.6	Very low	91 Å²	91	136.4 Å²	136.4	64%	0.636	79%	0.79	S	S	*	*				-179	133.6	112.4	-91.1	0	0	0	0	116.3
56	K	31.5	Very low	30.5	Very low	176 Å²	176	134.5 Å²	134.5	77%	0.765	79%	0.788	S	S	*	*			trans	57	107.2	135	-58.3	173.6	-173.5	171.8	0	118.1
57	I	28.3	Very low	30.5	Very low	159 Å²	159	135.7 Å²	135.7	82%	0.815	79%	0.788	S	S	*	*				63.8	113.2	90.3	-62.5	161.6	0	0	0	113.4
58	S	28.1	Very low	30.8	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	77%	0.772	S	S	*	*				-169.8	169.4	107.1	-153.6	0	0	0	0	113.9
59	L	29.5	Very low	30.6	Very low	165 Å²	165	129.8 Å²	129.8	86%	0.864	76%	0.763	S	S	*	*			trans	-79.7	171.9	-172.8	-72.1	153.8	0	0	0	114.4
60	R	27.5	Very low	30.6	Very low	242 Å²	242	130.8 Å²	130.8	91%	0.913	75%	0.752	S	S	*	*			trans	87.6	83.8	148.8	-148.4	178.4	-154.5	177.1	6.1	116.7
61	G	36.8	Very low	30.5	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	75%	0.751	S	S	*	*			trans	-77.4	156.7	167.8	0	0	0	0	0	113.6
62	P	32.6	Very low	30.7	Very low	112 Å²	112	134.4 Å²	134.4	73%	0.727	76%	0.758	S	S	*	*			trans	-128	171.2	164.1	39.9	-28.1	0	0	0	114
63	S	27.1	Very low	30.7	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	76%	0.761	S	S	*	*	S	Bend	trans	49.6	123.8	146.6	60.6	0	0	0	0	121.2	G65	S63-G65 PolarHBondContact O-N 3.28Å; S63-G65 VanDerWaalsContact O-N 3.1Å
64	S	26.9	Very low	30.7	Very low	129 Å²	129	133.2 Å²	133.2	90%	0.902	76%	0.758	S	S	*	*			trans	-2.8	97.7	138.4	54	0	0	0	0	116
65	G	28.8	Very low	31	Very low	68 Å²	68	132.6 Å²	132.6	70%	0.701	76%	0.759	S	S	*	*			trans	-133.9	144.6	172.5	0	0	0	0	0	109.9	S63	S63-G65 PolarHBondContact O-N 3.28Å; S63-G65 VanDerWaalsContact O-N 3.1Å
66	E	26.2	Very low	31.3	Very low	157 Å²	157	131.6 Å²	131.6	73%	0.734	76%	0.763	S	S	*	*			trans	-55.1	146.9	-177	-69.7	155.1	162.6	0	0	115	E68	E66-E68 HydrophobicContact CB-CB 3.75Å; E66-E68 HydrophobicContact CB-CG 4.08Å; E66-E68 HydrophobicContact CG-CB 4.22Å; E66-E68 HydrophobicContact CG-CG 3.98Å
67	N	36.1	Very low	31.5	Very low	145 Å²	145	130.3 Å²	130.3	78%	0.775	77%	0.765	S	S	*	*				-121.2	72.6	126.3	-75.4	-91.8	0	0	0	106.4	L69 T70	N67-L69 VanDerWaalsContact C-N 3.32Å; N67-T70 PolarHBondContact O-N 3.04Å
68	E	38.1	Very low	31.9	Very low	130 Å²	130	125.9 Å²	125.9	61%	0.607	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn		-18.4	92	90.4	-71.4	-75.3	120.4	0	0	112.5	E66	E66-E68 HydrophobicContact CB-CB 3.75Å; E66-E68 HydrophobicContact CB-CG 4.08Å; E66-E68 HydrophobicContact CG-CB 4.22Å; E66-E68 HydrophobicContact CG-CG 3.98Å
69	L	33	Very low	32.5	Very low	123 Å²	123	130.4 Å²	130.4	64%	0.644	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	cis	-134	105.6	2.2	-90.3	171.3	0	0	0	113.3	N67	N67-L69 VanDerWaalsContact C-N 3.32Å
70	T	33.4	Very low	33.2	Very low	105 Å²	105	131.8 Å²	131.8	64%	0.644	76%	0.763	S	S	*	*			trans	60.1	96.4	140.3	58	0	0	0	0	117.9	N67	N67-T70 PolarHBondContact O-N 3.04Å
71	G	27.9	Very low	34.5	Very low	67 Å²	67	125.8 Å²	125.8	69%	0.691	75%	0.746	S	S	*	*			trans	24.9	122.7	135.1	0	0	0	0	0	120.8
72	K	34.5	Very low	35.7	Very low	191 Å²	191	125 Å²	125	83%	0.83	73%	0.729	S	S	*	*			trans	-134	89.9	131.1	-101.4	110.4	-172.3	173.9	0	110.9	C74	K72-C74 PolarHBondContact O-N 2.74Å
73	L	28.5	Very low	37.6	Very low	171 Å²	171	124 Å²	124	90%	0.895	73%	0.725	S	S	*	*			trans	-64.1	109.2	147.8	-82.6	164.5	0	0	0	107.3
74	C	32.9	Very low	39.7	Very low	107 Å²	107	127.5 Å²	127.5	72%	0.723	72%	0.723	S	S	*	*			trans	-114.4	90.4	166.2	-72.2	0	0	0	0	108.2	K72 G76	K72-C74 PolarHBondContact O-N 2.74Å; C74-G76 PolarHBondContact O-N 2.79Å
75	I	33.8	Very low	41.8	Very low	160 Å²	160	126.1 Å²	126.1	82%	0.821	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-61.7	117.6	162.4	-61.5	172.1	0	0	0	106	D77	I75-D77 PolarHBondContact O-N 3.29Å
76	G	36.6	Very low	44	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-72.3	116.8	-176.9	0	0	0	0	0	111.3	C74	C74-G76 PolarHBondContact O-N 2.79Å
77	D	35.5	Very low	46.5	Very low	149 Å²	149	125.2 Å²	125.2	80%	0.797	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-54.8	143.9	175.5	-84.3	-53.1	0	0	0	112.2	I75 F79	I75-D77 PolarHBondContact O-N 3.29Å; D77-F79 PolarHBondContact O-N 2.99Å
78	G	36.5	Very low	48.5	Very low	66 Å²	66	122.5 Å²	122.5	68%	0.68	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-57.8	129.4	175.8	0	0	0	0	0	112.1	K80	G78-K80 PolarHBondContact O-N 2.95Å
79	F	41.4	Very low	50.6	Low	210 Å²	210	120.2 Å²	120.2	92%	0.921	66%	0.661	S	S	*	*			trans	-60.8	110	-178.4	-88.5	-97	0	0	0	111.5	D77 M81	D77-F79 PolarHBondContact O-N 2.99Å; F79-M81 PolarHBondContact O-N 3.27Å
80	K	43.8	Very low	52.7	Low	194 Å²	194	119 Å²	119	84%	0.843	66%	0.655	S	S	*	*			trans	-69.4	107	164.7	-65.9	160.7	-174.2	156.7	0	107.2	G78	G78-K80 PolarHBondContact O-N 2.95Å
81	M	54.5	Low	54.8	Low	116 Å²	116	115.8 Å²	115.8	57%	0.571	64%	0.639	S	S	*	*			trans	-54.6	145.8	169.4	-67.9	-160.4	-61.9	0	0	109.8	F79	F79-M81 PolarHBondContact O-N 3.27Å
82	S	61.7	Low	57	Low	58 Å²	58	118.7 Å²	118.7	41%	0.406	64%	0.635	S	S	.	*			trans	-61.8	142.3	176.5	-177.4	0	0	0	0	110	R84 E85 Q86	S82-R84 PolarHBondContact O-N 3.25Å; S82-R84 PolarHBondContact OG-N 3.3Å; S82-E85 WeakPolarHBondContact CB-OE2 3.37Å; S82-E85 PolarHBondContact N-OE2 3.1Å; S82-E85 PolarHBondContact O-N 2.85Å; S82-Q86 PolarHBondContact O-N 2.84Å
83	S	71.5	Confident	58.8	Low	92 Å²	92	114.2 Å²	114.2	64%	0.643	62%	0.62	S	S	*	*	H	α-helix	trans	-58.7	-22.5	172	55.5	0	0	0	0	112.1	V87	S83-V87 VanDerWaalsContact O-CG2 3.29Å; S83-V87 WeakPolarHBondContact O-CG2 3.33Å; S83-V87 PolarHBondContact O-N 3.01Å; S83-V87 VanDerWaalsContact O-N 3.1Å
84	R	71.6	Confident	60.9	Low	170 Å²	170	111 Å²	111	64%	0.642	60%	0.6	S	S	*	*	H	α-helix	trans	-71	-46.7	171.7	-175.1	174.4	177.3	160.5	4.1	112.7	S82 Q86 V87 E88	S82-R84 PolarHBondContact O-N 3.25Å; S82-R84 PolarHBondContact OG-N 3.3Å; R84-Q86 VanDerWaalsContact C-N 3.27Å; R84-Q86 PolarHBondContact O-N 3.49Å; R84-V87 PolarHBondContact O-N 2.96Å; R84-E88 HydrophobicContact CG-CG 4.5Å; R84-E88 IonicContact CZ-OE1 3.43Å; R84-E88 VanDerWaalsContact CZ-OE1 3.32Å; R84-E88 IonicContact NE-OE1 3.43Å; R84-E88 PolarHBondContact NE-OE1 2.7Å; R84-E88 IonicContact NE-OE2 2.8Å; R84-E88 IonicContact NH2-OE1 3.93Å; R84-E88 PolarHBondContact NH2-OE1 3.19Å; R84-E88 WeakPolarHBondContact O-CB 3.45Å; R84-E88 PolarHBondContact O-N 2.93Å
85	E	70.9	Confident	62.8	Low	99 Å²	99	113 Å²	113	46%	0.463	60%	0.597	S	S	.	*	H	α-helix	trans	-61.9	-39	174.6	-68.6	167.5	119	0	0	110.6	S82 V87 E88 N89	S82-E85 WeakPolarHBondContact CB-OE2 3.37Å; S82-E85 PolarHBondContact N-OE2 3.1Å; S82-E85 PolarHBondContact O-N 2.85Å; E85-V87 VanDerWaalsContact C-N 3.34Å; E85-V87 PolarHBondContact O-N 2.88Å; E85-E88 PolarHBondContact O-N 3.19Å; E85-N89 VanDerWaalsContact O-CB 3.22Å; E85-N89 WeakPolarHBondContact O-CB 3.23Å; E85-N89 VanDerWaalsContact O-CG 3.23Å; E85-N89 PolarHBondContact O-N 2.88Å; E85-N89 PolarHBondContact O-ND2 2.9Å
86	Q	76.2	Confident	64.1	Low	110 Å²	110	110.6 Å²	110.6	51%	0.514	58%	0.582	S	S	.	*	H	α-helix	trans	-65	-36.9	177.3	-162.4	172.3	25.8	0	0	112.3	S82 R84 N90	S82-Q86 PolarHBondContact O-N 2.84Å; R84-Q86 VanDerWaalsContact C-N 3.27Å; R84-Q86 PolarHBondContact O-N 3.49Å; Q86-N90 WeakPolarHBondContact O-CB 3.22Å; Q86-N90 PolarHBondContact O-N 3.32Å; Q86-N90 VanDerWaalsContact O-N 3.1Å; Q86-N90 PolarHBondContact O-OD1 3.36Å
87	V	77.4	Confident	65.3	Low	97 Å²	97	111.6 Å²	111.6	59%	0.588	57%	0.571	S	S	*	*	H	α-helix	trans	-73.6	-43.3	174.2	168	0	0	0	0	111.9	S83 R84 E85 N90 A91	S83-V87 VanDerWaalsContact O-CG2 3.29Å; S83-V87 WeakPolarHBondContact O-CG2 3.33Å; S83-V87 PolarHBondContact O-N 3.01Å; S83-V87 VanDerWaalsContact O-N 3.1Å; R84-V87 PolarHBondContact O-N 2.96Å; E85-V87 VanDerWaalsContact C-N 3.34Å; E85-V87 PolarHBondContact O-N 2.88Å; V87-N90 PolarHBondContact O-N 3.42Å; V87-A91 WeakPolarHBondContact O-CB 3.18Å; V87-A91 PolarHBondContact O-N 3.2Å
88	E	79.8	Confident	66.2	Low	88 Å²	88	110.6 Å²	110.6	41%	0.411	56%	0.561	S	S	.	*	H	α-helix	trans	-67.2	-35.3	178.9	-74.2	172.4	-177.1	0	0	111.6	R84 E85 Q92	R84-E88 HydrophobicContact CG-CG 4.5Å; R84-E88 IonicContact CZ-OE1 3.43Å; R84-E88 VanDerWaalsContact CZ-OE1 3.32Å; R84-E88 IonicContact NE-OE1 3.43Å; R84-E88 PolarHBondContact NE-OE1 2.7Å; R84-E88 IonicContact NE-OE2 2.8Å; R84-E88 IonicContact NH2-OE1 3.93Å; R84-E88 PolarHBondContact NH2-OE1 3.19Å; R84-E88 WeakPolarHBondContact O-CB 3.45Å; R84-E88 PolarHBondContact O-N 2.93Å; E85-E88 PolarHBondContact O-N 3.19Å; E88-Q92 WeakPolarHBondContact O-CG 3.24Å; E88-Q92 PolarHBondContact O-N 3.22Å; E88-Q92 VanDerWaalsContact O-N 3.12Å
89	N	80.5	Confident	66.7	Low	81 Å²	81	118 Å²	118	43%	0.433	57%	0.568	S	S	.	*	H	α-helix	trans	-67.3	-46.5	171	-75.6	-22.2	0	0	0	112.1	E85 A91 Q92 L93	E85-N89 VanDerWaalsContact O-CB 3.22Å; E85-N89 WeakPolarHBondContact O-CB 3.23Å; E85-N89 VanDerWaalsContact O-CG 3.23Å; E85-N89 PolarHBondContact O-N 2.88Å; E85-N89 PolarHBondContact O-ND2 2.9Å; N89-A91 VanDerWaalsContact C-N 3.31Å; N89-A91 PolarHBondContact O-N 3.17Å; N89-Q92 PolarHBondContact O-N 3.29Å; N89-Q92 VanDerWaalsContact O-N 3.11Å; N89-L93 PolarHBondContact O-N 3.48Å
90	N	78	Confident	66.9	Low	97 Å²	97	114.6 Å²	114.6	52%	0.519	56%	0.555	S	S	.	*	H	α-helix	trans	-60.4	-41.7	176.8	-74.2	1.2	0	0	0	111.6	Q86 V87 Q92 L93 E94	Q86-N90 WeakPolarHBondContact O-CB 3.22Å; Q86-N90 PolarHBondContact O-N 3.32Å; Q86-N90 VanDerWaalsContact O-N 3.1Å; Q86-N90 PolarHBondContact O-OD1 3.36Å; V87-N90 PolarHBondContact O-N 3.42Å; N90-Q92 PolarHBondContact O-N 3.39Å; N90-L93 PolarHBondContact O-N 3.01Å; N90-E94 WeakPolarHBondContact O-CB 3.46Å; N90-E94 PolarHBondContact O-N 3.4Å
91	A	77	Confident	66.7	Low	38 Å²	38	108.6 Å²	108.6	31%	0.314	55%	0.549	S	S	.	.	H	α-helix	trans	-72.6	-13.2	177.4	0	0	0	0	0	114.1	V87 N89 K95	V87-A91 WeakPolarHBondContact O-CB 3.18Å; V87-A91 PolarHBondContact O-N 3.2Å; N89-A91 VanDerWaalsContact C-N 3.31Å; N89-A91 PolarHBondContact O-N 3.17Å; A91-K95 VanDerWaalsContact O-CD 3.27Å; A91-K95 WeakPolarHBondContact O-CD 3.37Å; A91-K95 VanDerWaalsContact O-CG 3.29Å; A91-K95 WeakPolarHBondContact O-CG 3.45Å
92	Q	73.6	Confident	66.1	Low	128 Å²	128	110 Å²	110	60%	0.598	56%	0.557	S	S	*	*	H	α-helix	trans	-86	-42.5	166	-75.3	-177.7	40.6	0	0	111.3	E88 N89 N90 E94 K95 Q96	E88-Q92 WeakPolarHBondContact O-CG 3.24Å; E88-Q92 PolarHBondContact O-N 3.22Å; E88-Q92 VanDerWaalsContact O-N 3.12Å; N89-Q92 PolarHBondContact O-N 3.29Å; N89-Q92 VanDerWaalsContact O-N 3.11Å; N90-Q92 PolarHBondContact O-N 3.39Å; Q92-E94 PolarHBondContact O-N 3.25Å; Q92-K95 PolarHBondContact O-N 3.42Å; Q92-Q96 PolarHBondContact O-N 2.78Å
93	L	74	Confident	64.8	Low	98 Å²	98	111.1 Å²	111.1	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-57.4	-48.7	175.6	-154.9	83.6	0	0	0	111	N89 N90 K95 Q96 D97	N89-L93 PolarHBondContact O-N 3.48Å; N90-L93 PolarHBondContact O-N 3.01Å; L93-K95 VanDerWaalsContact C-N 3.29Å; L93-K95 PolarHBondContact O-N 2.68Å; L93-Q96 CarbonylContact O-C 3.56Å; L93-Q96 WeakPolarHBondContact O-CA 3.25Å; L93-Q96 WeakPolarHBondContact O-CB 3.03Å; L93-Q96 PolarHBondContact O-N 2.91Å; L93-D97 PolarHBondContact O-N 3.39Å
94	E	71.3	Confident	63	Low	103 Å²	103	109.9 Å²	109.9	48%	0.481	57%	0.571	S	S	.	*	H	α-helix	trans	-60.4	-36.7	178.2	-172.4	168.2	-140.9	0	0	112.1	N90 Q92 Q96 H98	N90-E94 WeakPolarHBondContact O-CB 3.46Å; N90-E94 PolarHBondContact O-N 3.4Å; Q92-E94 PolarHBondContact O-N 3.25Å; E94-Q96 VanDerWaalsContact C-N 3.31Å; E94-H98 WeakPolarHBondContact O-CB 3.49Å; E94-H98 PolarHBondContact O-N 2.86Å; E94-H98 PolarHBondContact O-ND1 3.09Å
95	K	73.1	Confident	61	Low	149 Å²	149	110.6 Å²	110.6	65%	0.648	58%	0.582	S	S	*	*	H	α-helix	trans	-73.2	-21.3	173.2	-72.7	174.3	-172.9	169.7	0	113.7	A91 Q92 L93 R99	A91-K95 VanDerWaalsContact O-CD 3.27Å; A91-K95 WeakPolarHBondContact O-CD 3.37Å; A91-K95 VanDerWaalsContact O-CG 3.29Å; A91-K95 WeakPolarHBondContact O-CG 3.45Å; Q92-K95 PolarHBondContact O-N 3.42Å; L93-K95 VanDerWaalsContact C-N 3.29Å; L93-K95 PolarHBondContact O-N 2.68Å; K95-R99 WeakPolarHBondContact O-CG 3.07Å; K95-R99 PolarHBondContact O-N 3.12Å
96	Q	61.4	Low	59.1	Low	109 Å²	109	114.4 Å²	114.4	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-82.7	-42.4	175.6	-164.8	167.4	7.4	0	0	110.3	Q92 L93 E94 H98 R99 Q100	Q92-Q96 PolarHBondContact O-N 2.78Å; L93-Q96 CarbonylContact O-C 3.56Å; L93-Q96 WeakPolarHBondContact O-CA 3.25Å; L93-Q96 WeakPolarHBondContact O-CB 3.03Å; L93-Q96 PolarHBondContact O-N 2.91Å; E94-Q96 VanDerWaalsContact C-N 3.31Å; Q96-H98 PolarHBondContact O-N 2.69Å; Q96-R99 CarbonylContact O-C 3.53Å; Q96-R99 WeakPolarHBondContact O-CA 3.5Å; Q96-R99 WeakPolarHBondContact O-CB 2.95Å; Q96-R99 PolarHBondContact O-N 3.27Å; Q96-Q100 PolarHBondContact O-N 2.99Å
97	D	62.5	Low	56.9	Low	92 Å²	92	117.1 Å²	117.1	49%	0.492	62%	0.618	S	S	.	*	H	α-helix	trans	-59.6	-44.1	170.2	-66.2	-26.3	0	0	0	110.9	L93 R99 Q100 G101	L93-D97 PolarHBondContact O-N 3.39Å; D97-R99 PolarHBondContact O-N 3.19Å; D97-R99 VanDerWaalsContact O-N 3.15Å; D97-Q100 PolarHBondContact O-N 3.34Å; D97-Q100 VanDerWaalsContact O-N 3.13Å; D97-G101 PolarHBondContact O-N 2.88Å
98	H	53.4	Low	54.8	Low	128 Å²	128	121.1 Å²	121.1	59%	0.593	64%	0.635	S	S	*	*	H	α-helix	trans	-67.7	-8.2	173.3	-76.1	71.5	0	0	0	114.3	E94 Q96 I102	E94-H98 WeakPolarHBondContact O-CB 3.49Å; E94-H98 PolarHBondContact O-N 2.86Å; E94-H98 PolarHBondContact O-ND1 3.09Å; Q96-H98 PolarHBondContact O-N 2.69Å; H98-I102 WeakPolarHBondContact O-CD1 3.27Å
99	R	47.8	Very low	52.4	Low	220 Å²	220	122.9 Å²	122.9	83%	0.83	65%	0.647	S	S	*	*	H	α-helix	trans	-101.1	-20.3	170.1	-82.3	-175	168.1	-150.4	-4.3	113.6	K95 Q96 D97	K95-R99 WeakPolarHBondContact O-CG 3.07Å; K95-R99 PolarHBondContact O-N 3.12Å; Q96-R99 CarbonylContact O-C 3.53Å; Q96-R99 WeakPolarHBondContact O-CA 3.5Å; Q96-R99 WeakPolarHBondContact O-CB 2.95Å; Q96-R99 PolarHBondContact O-N 3.27Å; D97-R99 PolarHBondContact O-N 3.19Å; D97-R99 VanDerWaalsContact O-N 3.15Å
100	Q	44.9	Very low	49.9	Very low	139 Å²	139	128.4 Å²	128.4	65%	0.65	67%	0.668	S	S	*	*	H	α-helix	trans	-93.9	-25.9	174.6	-67.6	-172.7	-3.6	0	0	112.4	Q96 D97 I102	Q96-Q100 PolarHBondContact O-N 2.99Å; D97-Q100 PolarHBondContact O-N 3.34Å; D97-Q100 VanDerWaalsContact O-N 3.13Å; Q100-I102 VanDerWaalsContact C-N 3.26Å; Q100-I102 PolarHBondContact O-N 3.39Å
101	G	38.7	Very low	47.6	Very low	68 Å²	68	127 Å²	127	70%	0.701	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	9.3	176.3	0	0	0	0	0	115.9	D97	D97-G101 PolarHBondContact O-N 2.88Å
102	I	42.8	Very low	45.5	Very low	146 Å²	146	132 Å²	132	75%	0.749	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	47.4	177.5	-40.5	-180	0	0	0	109.7	H98 Q100	H98-I102 WeakPolarHBondContact O-CD1 3.27Å; Q100-I102 VanDerWaalsContact C-N 3.26Å; Q100-I102 PolarHBondContact O-N 3.39Å
103	A	34.8	Very low	43.3	Very low	82 Å²	82	134.8 Å²	134.8	68%	0.678	72%	0.716	S	S	*	*			trans	-145.6	107.2	173	0	0	0	0	0	109.1
104	G	33.4	Very low	41.2	Very low	65 Å²	65	135.4 Å²	135.4	67%	0.67	73%	0.725	S	S	*	*			trans	102.1	115.4	-171.6	0	0	0	0	0	112.2
105	E	28.6	Very low	39.1	Very low	186 Å²	186	138.7 Å²	138.7	87%	0.869	74%	0.735	S	S	*	*			cis	59.3	125.7	13.1	-78.2	173	-179.3	0	0	112.9
106	E	31.3	Very low	36.9	Very low	178 Å²	178	140.2 Å²	140.2	83%	0.832	75%	0.748	S	S	*	*			cis	-138.6	-172.1	6.2	-60.8	-172.9	94.3	0	0	111.7	L108	E106-L108 PolarHBondContact O-N 3.39Å
107	N	29.9	Very low	35.2	Very low	167 Å²	167	138 Å²	138	89%	0.893	75%	0.754	S	S	*	*			trans	-65.2	118.7	166.1	-66.9	-80	0	0	0	110.6
108	L	34.9	Very low	33.6	Very low	182 Å²	182	141.9 Å²	141.9	95%	0.953	77%	0.77	S	S	*	*			trans	-102.4	123.7	165.1	-93.7	167.6	0	0	0	111	E106	E106-L108 PolarHBondContact O-N 3.39Å
109	N	29	Very low	33	Very low	125 Å²	125	141 Å²	141	67%	0.668	78%	0.775	S	S	*	*			trans	-113.7	145.3	-172.6	-162.6	6	0	0	0	110.4
110	F	28.1	Very low	32.2	Very low	197 Å²	197	135.3 Å²	135.3	86%	0.864	78%	0.775	S	S	*	*			trans	63	150.7	179.3	-68.3	-80.9	0	0	0	118.7
111	G	28.5	Very low	31.7	Very low	67 Å²	67	137.6 Å²	137.6	69%	0.691	78%	0.783	S	S	*	*			trans	-175.1	36.8	-173.5	0	0	0	0	0	115.9
112	T	32.6	Very low	31.5	Very low	142 Å²	142	141.6 Å²	141.6	87%	0.871	79%	0.788	S	S	*	*			trans	41.7	109.4	162.3	43.1	0	0	0	0	120.6
113	Q	27.7	Very low	30.9	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	80%	0.795	S	S	*	*			trans	-118.6	133.6	149.6	-90.7	-79.3	-12.7	0	0	108.4
114	P	31.4	Very low	30.7	Very low	110 Å²	110	147.4 Å²	147.4	71%	0.714	80%	0.802	S	S	*	*			trans	-92.7	128.1	-165.4	33.7	-34.7	0	0	0	115.8
115	Y	26.3	Very low	30.7	Very low	172 Å²	172	150.3 Å²	150.3	68%	0.675	81%	0.806	S	S	*	*			trans	44	99.9	132.1	-122.8	-101.2	0	0	0	120.5	Q118	Y115-Q118 PolarHBondContact OH-O 3.14Å
116	I	26.2	Very low	30.8	Very low	181 Å²	181	147.7 Å²	147.7	93%	0.928	80%	0.803	S	S	*	*			trans	-135.8	106.6	134.6	-58	-179.8	0	0	0	107
117	G	27.1	Very low	30.7	Very low	62 Å²	62	144.9 Å²	144.9	64%	0.639	80%	0.797	S	S	*	*	S	Bend	trans	151.3	64.4	173.5	0	0	0	0	0	118.3
118	Q	28	Very low	31	Very low	175 Å²	175	146.8 Å²	146.8	82%	0.818	80%	0.798	S	S	*	*			trans	63.2	153.8	160.4	-69.1	-174.7	-25.1	0	0	119.6	Y115	Y115-Q118 PolarHBondContact OH-O 3.14Å
119	P	40.1	Very low	30.8	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	80%	0.795	S	S	*	*			trans	-100.6	149.2	-175.6	38.4	-33	0	0	0	114
120	A	32.8	Very low	30.8	Very low	99 Å²	99	143.7 Å²	143.7	82%	0.818	80%	0.801	S	S	*	*			trans	-128.5	143.2	149.5	0	0	0	0	0	107.5
121	K	33.1	Very low	31.3	Very low	187 Å²	187	139.9 Å²	139.9	81%	0.813	80%	0.799	S	S	*	*			trans	-78.7	155.8	176.3	-64	-178.8	178.7	179.5	0	110.3
122	D	34.2	Very low	31.3	Very low	152 Å²	152	146.2 Å²	146.2	81%	0.813	81%	0.811	S	S	*	*			trans	57	103.4	160.3	-46.5	-36.7	0	0	0	116.4
123	Q	31.2	Very low	31.2	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	80%	0.804	S	S	*	*			trans	-123.7	116.3	179.1	-170.1	170.9	104.8	0	0	110.6
124	I	30.8	Very low	31.3	Very low	158 Å²	158	141.7 Å²	141.7	81%	0.81	80%	0.8	S	S	*	*			trans	-111	142.1	177.1	-65.4	175.1	0	0	0	108.9
125	V	32.2	Very low	31.1	Very low	126 Å²	126	142.9 Å²	142.9	76%	0.764	81%	0.806	S	S	*	*			trans	-97.6	124.5	178	178.3	0	0	0	0	110.5
126	V	31	Very low	31.5	Very low	131 Å²	131	142.8 Å²	142.8	79%	0.794	82%	0.816	S	S	*	*			trans	-139.6	137.4	160.1	-177.7	0	0	0	0	108.8
127	T	30.5	Very low	31.7	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	81%	0.809	S	S	*	*			trans	-101.9	151.8	-178.6	48	0	0	0	0	112.3
128	K	36.2	Very low	32	Very low	208 Å²	208	142.2 Å²	142.2	90%	0.904	81%	0.81	S	S	*	*			trans	-140.6	164.7	158	-76.5	-159	175	-177.4	0	110.9
129	T	28.8	Very low	32	Very low	146 Å²	146	140 Å²	140	90%	0.896	81%	0.809	S	S	*	*			trans	-105.9	177.9	-150.2	38.4	0	0	0	0	115.2
130	A	29.9	Very low	31.5	Very low	95 Å²	95	140 Å²	140	79%	0.785	81%	0.811	S	S	*	*			trans	-68.7	167.7	-168.9	0	0	0	0	0	115.7
131	S	38.6	Very low	31.4	Very low	118 Å²	118	143 Å²	143	83%	0.825	81%	0.813	S	S	*	*			trans	-146.1	137.4	164	-62.7	0	0	0	0	109
132	E	27.8	Very low	31.5	Very low	200 Å²	200	145 Å²	145	94%	0.935	82%	0.816	S	S	*	*			trans	-90.9	136	178.1	-57.8	178.1	131.6	0	0	110.2
133	S	31.2	Very low	31.6	Very low	104 Å²	104	143.6 Å²	143.6	73%	0.727	81%	0.808	S	S	*	*			trans	-154.8	110.3	168.7	61.8	0	0	0	0	113.9
134	T	29.9	Very low	32	Very low	130 Å²	130	139.7 Å²	139.7	80%	0.798	80%	0.802	S	S	*	*			trans	38.3	125.1	141.5	50.6	0	0	0	0	121.7
135	T	27.1	Very low	32.9	Very low	136 Å²	136	134.1 Å²	134.1	83%	0.834	78%	0.777	S	S	*	*			trans	-38.5	141.1	158.8	48.4	0	0	0	0	116.4
136	L	35.3	Very low	33.4	Very low	169 Å²	169	136.4 Å²	136.4	89%	0.885	78%	0.779	S	S	*	*			trans	-121.2	116.3	161.8	-70	175.3	0	0	0	111.8
137	T	29.1	Very low	34.1	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	77%	0.768	S	S	*	*			trans	-89	176.6	143.7	53	0	0	0	0	107.5
138	P	34.4	Very low	34.6	Very low	101 Å²	101	133.3 Å²	133.3	66%	0.656	75%	0.748	S	S	*	*			cis	-137.9	-157.5	9.9	40.6	-19.2	0	0	0	113.9
139	T	28.2	Very low	35.2	Very low	130 Å²	130	128.1 Å²	128.1	80%	0.798	73%	0.73	S	S	*	*			trans	65.1	157.9	155.6	42.8	0	0	0	0	118.7
140	S	28.9	Very low	36	Very low	109 Å²	109	129.4 Å²	129.4	76%	0.762	73%	0.726	S	S	*	*			cis	-150.4	177.5	-22.5	-166.8	0	0	0	0	108.5
141	L	32	Very low	36.8	Very low	163 Å²	163	128.9 Å²	128.9	85%	0.853	71%	0.709	S	S	*	*			trans	-61.7	143.3	168.2	-69.2	156.5	0	0	0	111.8
142	R	34.5	Very low	37.1	Very low	229 Å²	229	126.4 Å²	126.4	86%	0.864	69%	0.687	S	S	*	*			trans	-154.7	161.1	148.3	-140.8	169.6	-174.1	165.9	2	111.1
143	D	35.9	Very low	38	Very low	122 Å²	122	120.9 Å²	120.9	65%	0.652	68%	0.675	S	S	*	*			trans	-91.3	173	-148	-40.4	-72.9	0	0	0	113.9
144	S	40.4	Very low	38.5	Very low	111 Å²	111	123.2 Å²	123.2	78%	0.776	68%	0.679	S	S	*	*			trans	-127	23.4	177.8	-57.5	0	0	0	0	113.1
145	S	48.3	Very low	39.5	Very low	41 Å²	41	123.8 Å²	123.8	29%	0.287	67%	0.67	S	S	.	*	G	3₁₀ helix	trans	-83.8	-7	-173.9	45.4	0	0	0	0	115	Q147 N208	S145-Q147 PolarHBondContact O-N 2.9Å; S145-N208 VanDerWaalsContact CB-OD1 3.25Å; S145-N208 WeakPolarHBondContact CB-OD1 3.49Å
146	E	42.8	Very low	40	Very low	174 Å²	174	124.1 Å²	124.1	81%	0.813	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-66.1	-21.3	178.3	-65.2	-169.5	144.2	0	0	113.1
147	Q	46.4	Very low	39.7	Very low	119 Å²	119	126.1 Å²	126.1	56%	0.556	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-82.2	-22.8	-165.5	-114.3	-169.9	-37.2	0	0	116.1	S145 L206	S145-Q147 PolarHBondContact O-N 2.9Å; Q147-L206 HydrophobicContact CB-CD1 3.89Å; Q147-L206 HydrophobicContact CB-CD2 3.95Å; Q147-L206 HydrophobicContact CB-CG 4.4Å; Q147-L206 HydrophobicContact CG-CD1 3.78Å; Q147-L206 HydrophobicContact CG-CD2 4.21Å
148	E	41.9	Very low	39.9	Very low	64 Å²	64	124.7 Å²	124.7	30%	0.299	66%	0.657	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.5	-24.3	176.4	-146.4	-169.1	-112.6	0	0	112.7	E150 L151 A207 N208	E148-E150 PolarHBondContact O-N 3.13Å; E148-L151 PolarHBondContact O-N 2.95Å; E148-A207 WeakPolarHBondContact OE1-CA 3.49Å; E148-N208 HydrophobicContact CB-CB 3.82Å; E148-N208 HydrophobicContact CG-CB 4.32Å; E148-N208 PolarHBondContact OE1-N 3.34Å
149	N	46.9	Very low	40	Very low	99 Å²	99	125.8 Å²	125.8	53%	0.529	67%	0.667	S	S	.	*	G	3₁₀ helix	trans	-73.7	-30.3	-169.2	-74.7	-25.6	0	0	0	113.7	L151 N152	N149-L151 VanDerWaalsContact C-N 3.26Å; N149-L151 PolarHBondContact O-N 3.41Å; N149-N152 PolarHBondContact O-N 3.33Å
150	E	47.7	Very low	40	Very low	173 Å²	173	124.1 Å²	124.1	81%	0.808	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-66.4	-26.3	174.8	-66.3	-160.9	142.6	0	0	113	E148	E148-E150 PolarHBondContact O-N 3.13Å
151	L	45.4	Very low	39.9	Very low	84 Å²	84	127.2 Å²	127.2	44%	0.44	66%	0.664	S	S	.	*	G	3₁₀ helix	trans	-79.2	-15	-178.8	-98.9	169.8	0	0	0	114.4	E148 N149	E148-L151 PolarHBondContact O-N 2.95Å; N149-L151 VanDerWaalsContact C-N 3.26Å; N149-L151 PolarHBondContact O-N 3.41Å
152	N	44.6	Very low	39.8	Very low	66 Å²	66	124.8 Å²	124.8	35%	0.353	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93	-27.6	178.1	-73.9	-48.6	0	0	0	113.1	N149 L154 K155	N149-N152 PolarHBondContact O-N 3.33Å; N152-L154 PolarHBondContact O-N 3.07Å; N152-K155 PolarHBondContact O-N 2.96Å; N152-K155 PolarHBondContact OD1-NZ 3.45Å
153	A	46.5	Very low	39.4	Very low	84 Å²	84	122.4 Å²	122.4	69%	0.694	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	-9.2	-175.8	0	0	0	0	0	115.8
154	L	42.6	Very low	39.1	Very low	154 Å²	154	121.4 Å²	121.4	81%	0.806	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	17.2	179.9	-149.3	74.1	0	0	0	114.4	N152	N152-L154 PolarHBondContact O-N 3.07Å
155	K	50	Low	38.7	Very low	141 Å²	141	123.1 Å²	123.1	61%	0.613	66%	0.66	S	S	*	*	S	Bend	trans	-86.2	-26.3	170.5	-73.3	171	-174	159.2	0	113.2	N152 Y157	N152-K155 PolarHBondContact O-N 2.96Å; N152-K155 PolarHBondContact OD1-NZ 3.45Å; K155-Y157 PolarHBondContact O-N 3.34Å
156	D	37.8	Very low	37.6	Very low	144 Å²	144	126.9 Å²	126.9	77%	0.77	69%	0.687	S	S	*	*			trans	-99	32.1	-166.4	-61.4	-36.6	0	0	0	114.5	P158	D156-P158 WeakPolarHBondContact O-CD 3.38Å
157	Y	30.2	Very low	37.1	Very low	211 Å²	211	125.5 Å²	125.5	83%	0.827	68%	0.684	S	S	*	*			trans	-88.5	109.4	165.2	-136	-77.2	0	0	0	109.3	K155	K155-Y157 PolarHBondContact O-N 3.34Å
158	P	33	Very low	36.2	Very low	99 Å²	99	130.3 Å²	130.3	64%	0.643	70%	0.697	S	S	*	*			trans	-75.3	157.2	-166	29.3	-36.1	0	0	0	114	D156 S160	D156-P158 WeakPolarHBondContact O-CD 3.38Å; P158-S160 PolarHBondContact O-N 3.25Å
159	S	35.7	Very low	35.5	Very low	124 Å²	124	129.9 Å²	129.9	87%	0.867	70%	0.697	S	S	*	*			trans	-72.3	102.3	172.6	164.3	0	0	0	0	111.7
160	S	28.2	Very low	34.8	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	70%	0.704	S	S	*	*			trans	-144.7	144	171.2	-58.7	0	0	0	0	110	P158	P158-S160 PolarHBondContact O-N 3.25Å
161	E	26.6	Very low	33.8	Very low	174 Å²	174	128.8 Å²	128.8	81%	0.813	70%	0.696	S	S	*	*			cis	-167	124.3	-22.9	-130.9	175.3	-166.2	0	0	105.9
162	S	30.2	Very low	33.3	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	72%	0.717	S	S	*	*			trans	-165.1	104.2	164.1	-11.3	0	0	0	0	113.5
163	E	26.8	Very low	32.4	Very low	179 Å²	179	137.1 Å²	137.1	84%	0.836	73%	0.731	S	S	*	*				56	102.2	128.8	-61.5	-175.5	154.9	0	0	120.5
164	S	28.5	Very low	31.5	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	73%	0.733	S	S	*	*				39.8	119	123.1	61.8	0	0	0	0	120
165	I	32.9	Very low	30.8	Very low	146 Å²	146	140.2 Å²	140.2	75%	0.749	72%	0.723	S	S	*	*				-165.2	123.9	95.8	-92.3	154.2	0	0	0	108.5	L167	I165-L167 HydrophobicContact CG2-CD1 4.17Å; I165-L167 HydrophobicContact CG2-CG 3.9Å
166	S	25.3	Very low	29.8	Very low	120 Å²	120	136 Å²	136	84%	0.839	71%	0.707	S	S	*	*			trans	-88.5	116.3	169.5	-178.9	0	0	0	0	109.2
167	L	32.1	Very low	29.5	Very low	145 Å²	145	134.2 Å²	134.2	76%	0.759	69%	0.694	S	S	*	*			trans	-119.2	116.1	167.9	-85.1	175.8	0	0	0	112.7	I165 L169	I165-L167 HydrophobicContact CG2-CD1 4.17Å; I165-L167 HydrophobicContact CG2-CG 3.9Å; L167-L169 PolarHBondContact O-N 3.2Å
168	R	26.8	Very low	29.6	Very low	220 Å²	220	129.9 Å²	129.9	83%	0.83	68%	0.684	S	S	*	*			trans	-36.2	124	157.1	-66.9	169	-175.9	169.1	0.5	110.1
169	L	28	Very low	29.3	Very low	55 Å²	55	126.6 Å²	126.6	29%	0.288	67%	0.668	S	S	.	*				58	118.4	89.3	-86.7	178.7	0	0	0	115	L167 R236 N237	L167-L169 PolarHBondContact O-N 3.2Å; L169-R236 HydrophobicContact CD1-CB 4.36Å; L169-R236 HydrophobicContact CD1-CG 4.06Å; L169-R236 WeakPolarHBondContact CD1-O 3.47Å; L169-R236 HydrophobicContact CD2-CG 4.02Å; L169-R236 VanDerWaalsContact CD2-NE 3.27Å; L169-N237 VanDerWaalsContact CD2-OD1 3.22Å; L169-N237 WeakPolarHBondContact CD2-OD1 3.26Å; L169-N237 WeakPolarHBondContact CG-OD1 3.36Å
170	L	32.7	Very low	29.2	Very low	132 Å²	132	126.2 Å²	126.2	69%	0.691	66%	0.66	S	S	*	*				-166.4	168.3	106.4	-103.6	162.3	0	0	0	111.5
171	N	26.1	Very low	29.4	Very low	118 Å²	118	126.9 Å²	126.9	63%	0.631	66%	0.663	S	S	*	*			trans	-89.1	148.8	162.2	-62.3	-1.3	0	0	0	107.1	R236	N171-R236 VanDerWaalsContact CG-NH2 3.33Å; N171-R236 PolarHBondContact OD1-NH2 2.72Å
172	F	34.4	Very low	29.5	Very low	200 Å²	200	127.4 Å²	127.4	88%	0.877	67%	0.665	S	S	*	*			trans	-131.7	135.7	145.5	-93.8	-79.8	0	0	0	110.2
173	D	25.9	Very low	29.8	Very low	124 Å²	124	127 Å²	127	66%	0.663	67%	0.668	S	S	*	*			trans	-94.3	-178.6	175.2	-146.2	-44.5	0	0	0	109.1
174	K	27	Very low	30	Very low	168 Å²	168	121.6 Å²	121.6	73%	0.73	66%	0.661	S	S	*	*			trans	-53.6	156.7	-178.5	-47.3	133	-169.1	112.7	0	113.2
175	K	28.4	Very low	30.3	Very low	135 Å²	135	123.4 Å²	123.4	59%	0.587	66%	0.663	S	S	*	*				173.9	146.2	116.3	-88.7	-179.2	178.8	173.8	0	108.8
176	D	28.5	Very low	30.6	Very low	54 Å²	54	122.7 Å²	122.7	29%	0.289	66%	0.658	S	S	.	*			cis	-144.2	167.1	-9.1	-97.1	-39.8	0	0	0	109.1	R939 A941	D176-R939 PolarHBondContact OD2-N 3.03Å; D176-A941 WeakPolarHBondContact O-CB 3.18Å; D176-A941 PolarHBondContact O-N 3.08Å
177	E	32.8	Very low	31	Very low	105 Å²	105	123.2 Å²	123.2	49%	0.491	65%	0.645	S	S	.	*			trans	56.9	154.8	145.7	-74.5	-150.4	-179.5	0	0	131.5	D940 A941	E177-D940 HydrophobicContact CB-CB 3.89Å; E177-D940 VanDerWaalsContact CB-OD1 3.27Å; E177-D940 WeakPolarHBondContact CB-OD1 3.13Å; E177-D940 WeakPolarHBondContact CG-OD1 3.46Å; E177-A941 CarbonylContact C-O 3.16Å; E177-A941 CarbonylContact O-C 3.53Å; E177-A941 VanDerWaalsContact O-C 3.25Å; E177-A941 VanDerWaalsContact O-O 3.09Å
178	I	31.6	Very low	31.2	Very low	121 Å²	121	122.3 Å²	122.3	62%	0.621	64%	0.637	S	S	*	*			trans	35.9	148.1	144.7	-67.9	-169.7	0	0	0	125.9	S942	I178-S942 WeakPolarHBondContact O-CA 3.49Å; I178-S942 WeakPolarHBondContact O-CB 3.49Å
179	G	27	Very low	31.6	Very low	30 Å²	30	114.7 Å²	114.7	31%	0.309	62%	0.621	S	S	.	*			trans	150.1	102.6	151.7	0	0	0	0	0	114.3	R943	G179-R943 WeakPolarHBondContact O-CD 3.38Å; G179-R943 PolarHBondContact O-NH1 3.23Å
180	T	34.2	Very low	31.9	Very low	115 Å²	115	116 Å²	116	71%	0.706	64%	0.639	S	S	*	*			trans	-135	144.2	179.9	-7.2	0	0	0	0	110
181	P	31.7	Very low	32	Very low	111 Å²	111	118.8 Å²	118.8	72%	0.721	65%	0.649	S	S	*	*				-123.8	157	88.9	35.2	-28.4	0	0	0	112.5
182	E	29	Very low	32.3	Very low	184 Å²	184	121 Å²	121	86%	0.86	66%	0.66	S	S	*	*			cis	94.1	150.4	37.1	-153.8	169.2	-127.1	0	0	114
183	A	35.3	Very low	32.4	Very low	102 Å²	102	117.3 Å²	117.3	84%	0.843	65%	0.65	S	S	*	*			trans	67.7	141.3	-173.2	0	0	0	0	0	119.4
184	G	31.7	Very low	33.1	Very low	67 Å²	67	114.7 Å²	114.7	69%	0.691	65%	0.645	S	S	*	*			trans	113.7	124.3	167.6	0	0	0	0	0	116.9
185	D	35.8	Very low	33.6	Very low	139 Å²	139	115 Å²	115	74%	0.743	66%	0.655	S	S	*	*			trans	-132.8	167.1	-148.3	-138.2	-28.8	0	0	0	118.7
186	M	38.2	Very low	34	Very low	132 Å²	132	113.2 Å²	113.2	65%	0.65	67%	0.665	S	S	*	*			trans	68.7	144.3	155.5	-68.4	-65.2	162.2	0	0	125.3	N1003	M186-N1003 VanDerWaalsContact C-ND2 3.32Å; M186-N1003 WeakPolarHBondContact O-CB 3.46Å; M186-N1003 PolarHBondContact O-ND2 2.94Å
187	K	33.2	Very low	34.4	Very low	131 Å²	131	118 Å²	118	57%	0.57	69%	0.69	S	S	*	*			trans	101.5	58	149.8	-79.5	171.3	167	-175.2	0	126.4	N1003 I1004 T1005	K187-N1003 HydrophobicContact CB-CB 3.84Å; K187-N1003 CarbonylContact O-C 3.56Å; K187-N1003 WeakPolarHBondContact O-CA 3.4Å; K187-N1003 WeakPolarHBondContact O-CB 3.06Å; K187-N1003 PolarHBondContact O-OD1 2.96Å; K187-I1004 PolarHBondContact O-N 3.39Å; K187-T1005 HydrophobicContact CB-CG2 4.24Å; K187-T1005 HydrophobicContact CD-CG2 3.56Å; K187-T1005 HydrophobicContact CG-CG2 3.93Å
188	E	36.9	Very low	34.8	Very low	126 Å²	126	123.2 Å²	123.2	59%	0.589	71%	0.712	S	S	*	*				44.3	148.8	129.5	-141.1	-167.7	175.4	0	0	126	K1006	E188-K1006 IonicContact OE1-NZ 3.64Å; E188-K1006 PolarHBondContact OE1-NZ 3.38Å; E188-K1006 IonicContact OE2-NZ 2.6Å; E188-K1006 PolarHBondContact OE2-NZ 3.45Å
189	A	35.3	Very low	35.2	Very low	60 Å²	60	122.3 Å²	122.3	50%	0.496	71%	0.714	S	S	.	*			trans	81.5	149.9	153.9	0	0	0	0	0	120.3
190	A	34.5	Very low	35.7	Very low	81 Å²	81	129.6 Å²	129.6	67%	0.669	74%	0.74	S	S	*	*			cis	-146.6	-165.9	3.2	0	0	0	0	0	113.8
191	E	34	Very low	35.9	Very low	191 Å²	191	130.4 Å²	130.4	89%	0.893	74%	0.736	S	S	*	*			trans	-121.6	177.1	-157.3	-57	171.3	125.4	0	0	118
192	L	33.9	Very low	35.9	Very low	165 Å²	165	130.8 Å²	130.8	86%	0.864	73%	0.726	S	S	*	*			trans	120.5	135.4	171.1	-70.9	171.4	0	0	0	113.8
193	D	36.1	Very low	36.1	Very low	123 Å²	123	128 Å²	128	66%	0.658	72%	0.716	S	S	*	*			cis	84.1	133.4	1.2	-137.9	69.2	0	0	0	117.6
194	A	41.1	Very low	36	Very low	68 Å²	68	129.1 Å²	129.1	56%	0.562	71%	0.706	S	S	*	*			cis	-171	168.3	-19.7	0	0	0	0	0	111.8
195	N	36.5	Very low	36.1	Very low	175 Å²	175	130.6 Å²	130.6	94%	0.936	70%	0.698	S	S	*	*			trans	153.6	144.5	152.4	-86.7	-59	0	0	0	115.2
196	A	37.7	Very low	36.2	Very low	97 Å²	97	127.7 Å²	127.7	80%	0.802	68%	0.682	S	S	*	*			trans	-169.5	156.5	167.2	0	0	0	0	0	113
197	D	37.1	Very low	36.5	Very low	155 Å²	155	124.7 Å²	124.7	83%	0.829	68%	0.678	S	S	*	*			trans	-116.8	164.2	-168.6	-52	-82.5	0	0	0	115.8
198	F	39.8	Very low	37.4	Very low	215 Å²	215	121.6 Å²	121.6	94%	0.943	67%	0.668	S	S	*	*			trans	-170.1	148.2	160.4	-94.5	-62.4	0	0	0	114.7
199	P	41	Very low	37.5	Very low	101 Å²	101	123 Å²	123	66%	0.656	67%	0.674	S	S	*	*			trans	-135.5	157.7	176	41.8	-27.4	0	0	0	119.4
200	E	37.7	Very low	37.8	Very low	183 Å²	183	129 Å²	129	86%	0.855	69%	0.692	S	S	*	*			trans	55.1	177.7	144	-61.3	172.8	98.8	0	0	120.7
201	E	37.3	Very low	37.8	Very low	133 Å²	133	131.9 Å²	131.9	62%	0.621	70%	0.695	S	S	*	*			cis	-161.2	176.2	6.8	-148.7	-151.8	135.2	0	0	112.5
202	K	31.1	Very low	37.6	Very low	119 Å²	119	130.8 Å²	130.8	52%	0.517	69%	0.69	S	S	.	*			trans	72.2	160.3	158.6	-69	176	159.5	57.3	0	119.6
203	L	34.4	Very low	38	Very low	125 Å²	125	131.2 Å²	131.2	65%	0.654	69%	0.687	S	S	*	*			cis	-166.8	178.3	-15.3	-114.3	172.5	0	0	0	112.8
204	M	33.3	Very low	37.9	Very low	126 Å²	126	134.7 Å²	134.7	62%	0.621	70%	0.696	S	S	*	*			trans	82.1	157.5	159.5	-49.6	-44.1	-80.5	0	0	121.4
205	D	32.9	Very low	37.3	Very low	98 Å²	98	138.6 Å²	138.6	52%	0.524	71%	0.708	S	S	.	*				-179.1	161.3	-52.8	-106.8	38.3	0	0	0	114.9
206	L	38.6	Very low	36.9	Very low	77 Å²	77	134.6 Å²	134.6	40%	0.403	70%	0.699	S	S	.	*			trans	75.1	173.5	153.1	-63.6	160.9	0	0	0	123.9	Q147	Q147-L206 HydrophobicContact CB-CD1 3.89Å; Q147-L206 HydrophobicContact CB-CD2 3.95Å; Q147-L206 HydrophobicContact CB-CG 4.4Å; Q147-L206 HydrophobicContact CG-CD1 3.78Å; Q147-L206 HydrophobicContact CG-CD2 4.21Å
207	A	44.9	Very low	36.6	Very low	70 Å²	70	136.5 Å²	136.5	58%	0.579	70%	0.701	S	S	*	*			trans	-162.7	158.8	-166.9	0	0	0	0	0	116.6	E148	E148-A207 WeakPolarHBondContact OE1-CA 3.49Å
208	N	51.6	Low	36.1	Very low	65 Å²	65	131.9 Å²	131.9	35%	0.348	69%	0.69	S	S	.	*			trans	-145.4	176.3	176.1	-134.8	-15.6	0	0	0	115.5	S145 E148	S145-N208 VanDerWaalsContact CB-OD1 3.25Å; S145-N208 WeakPolarHBondContact CB-OD1 3.49Å; E148-N208 HydrophobicContact CB-CB 3.82Å; E148-N208 HydrophobicContact CG-CB 4.32Å; E148-N208 PolarHBondContact OE1-N 3.34Å
209	E	38.7	Very low	35.6	Very low	156 Å²	156	130.4 Å²	130.4	73%	0.729	69%	0.691	S	S	*	*			trans	-91.6	137.1	-174.6	-63.1	173.8	134.4	0	0	114.3
210	E	40.9	Very low	35.4	Very low	185 Å²	185	130.7 Å²	130.7	86%	0.864	70%	0.701	S	S	*	*				84.1	150.4	75.3	-159.3	165.2	-123	0	0	116.8
211	I	34.4	Very low	34.8	Very low	143 Å²	143	125.4 Å²	125.4	73%	0.733	70%	0.696	S	S	*	*			trans	104.5	98.5	166.4	-53.2	-177.9	0	0	0	119.6
212	E	31.4	Very low	34.3	Very low	168 Å²	168	127.9 Å²	127.9	79%	0.785	71%	0.708	S	S	*	*			trans	50.7	107.2	135.5	-55	-164.9	131.4	0	0	125.5
213	Q	40.8	Very low	35.2	Very low	173 Å²	173	126.4 Å²	126.4	81%	0.808	71%	0.71	S	S	*	*				29.7	122.9	121.8	-57	-176.9	31	0	0	122
214	K	35.1	Very low	34.8	Very low	197 Å²	197	129.8 Å²	129.8	86%	0.857	72%	0.72	S	S	*	*			trans	-145.5	118.4	132.7	-73.3	-157.3	178	179.5	0	108
215	D	27.9	Very low	34.6	Very low	149 Å²	149	128.2 Å²	128.2	80%	0.797	73%	0.727	S	S	*	*				84.2	129.1	74.9	-94.2	-35.9	0	0	0	114.7
216	A	28.1	Very low	34.5	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	74%	0.743	S	S	*	*			trans	49.5	152.2	160.8	0	0	0	0	0	119.5
217	T	32.1	Very low	33.9	Very low	138 Å²	138	137.4 Å²	137.4	85%	0.847	76%	0.764	S	S	*	*			cis	-148.3	163.7	13.6	-27.9	0	0	0	0	109.1
218	G	26.3	Very low	33.6	Very low	57 Å²	57	135.7 Å²	135.7	59%	0.588	75%	0.75	S	S	*	*				79.1	88.5	93.5	0	0	0	0	0	112.9
219	L	28.8	Very low	32.6	Very low	185 Å²	185	139.6 Å²	139.6	97%	0.969	77%	0.766	S	S	*	*				61.4	80.2	85.8	-69.9	173.3	0	0	0	115.7
220	A	37.4	Very low	32	Very low	106 Å²	106	133.4 Å²	133.4	88%	0.876	74%	0.744	S	S	*	*			trans	-154.4	157.7	152	0	0	0	0	0	109.5
221	G	24.3	Very low	31.6	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	73%	0.734	S	S	*	*			cis	152	57.5	-3.4	0	0	0	0	0	113.9
222	E	26.9	Very low	31.4	Very low	186 Å²	186	131.4 Å²	131.4	87%	0.869	74%	0.739	S	S	*	*			trans	68.9	-168.2	164.2	-125.3	-155.7	160.2	0	0	115.7
223	P	49.7	Very low	31.3	Very low	88 Å²	88	129.4 Å²	129.4	57%	0.571	74%	0.743	S	S	*	*				-137.9	-172.3	-109.5	45.7	-27.5	0	0	0	118.3
224	K	26.8	Very low	30.9	Very low	196 Å²	196	130.1 Å²	130.1	85%	0.852	74%	0.744	S	S	*	*			trans	79.8	148	156.5	-69.9	174.1	179.5	174.3	0	119
225	A	29.5	Very low	30.9	Very low	93 Å²	93	129.6 Å²	129.6	77%	0.769	74%	0.742	S	S	*	*			trans	58.6	80.5	148.1	0	0	0	0	0	120.6
226	Q	29.5	Very low	30.9	Very low	186 Å²	186	128.1 Å²	128.1	87%	0.869	73%	0.725	S	S	*	*				-156.7	120.8	116.1	-101.2	165	-8	0	0	106.1
227	E	26.9	Very low	31.1	Very low	182 Å²	182	128.9 Å²	128.9	85%	0.85	72%	0.717	S	S	*	*				76.7	96.4	60.8	-172.7	157.1	-119.4	0	0	113.7
228	A	38.5	Very low	31.2	Very low	33 Å²	33	126.2 Å²	126.2	27%	0.273	71%	0.709	S	S	.	*			trans	-174.1	124.9	164.1	0	0	0	0	0	104.9	K918 D919 N920	A228-K918 PolarHBondContact O-NZ 2.94Å; A228-D919 VanDerWaalsContact O-OD2 3.06Å; A228-N920 WeakPolarHBondContact CA-ND2 3.37Å; A228-N920 HydrophobicContact CB-CB 3.36Å; A228-N920 VanDerWaalsContact CB-CG 3.41Å; A228-N920 VanDerWaalsContact CB-ND2 3.32Å; A228-N920 WeakPolarHBondContact CB-ND2 3.11Å
229	Q	31.1	Very low	31.6	Very low	148 Å²	148	131.7 Å²	131.7	69%	0.692	72%	0.724	S	S	*	*			trans	-116	158.3	-169.1	97.3	-153.5	141.7	0	0	115.1	D919 N920	Q229-D919 WeakPolarHBondContact CA-OD2 3.29Å; Q229-D919 WeakPolarHBondContact O-CB 3.27Å; Q229-N920 PolarHBondContact N-OD1 3.15Å; Q229-N920 WeakPolarHBondContact O-CA 3.32Å; Q229-N920 PolarHBondContact O-OD1 3.36Å
230	G	26	Very low	31.6	Very low	25 Å²	25	125.8 Å²	125.8	26%	0.258	71%	0.708	S	S	.	*			trans	-66.2	-177.6	-169.8	0	0	0	0	0	117.1	D919	G230-D919 WeakPolarHBondContact CA-OD1 3.5Å; G230-D919 PolarHBondContact N-OD1 2.93Å; G230-D919 VanDerWaalsContact N-OD1 3.11Å; G230-D919 PolarHBondContact N-OD2 3.3Å
231	T	32.5	Very low	31.2	Very low	108 Å²	108	127 Å²	127	66%	0.663	71%	0.705	S	S	*	*			cis	-171.5	158.7	41.8	40.8	0	0	0	0	115.7
232	H	28.7	Very low	31.6	Very low	178 Å²	178	132 Å²	132	82%	0.824	71%	0.707	S	S	*	*			trans	41.7	115.4	144.2	-66.6	-62	0	0	0	121.8	K917	H232-K917 PolarHBondContact NE2-NZ 2.8Å
233	S	31	Very low	32.1	Very low	126 Å²	126	131 Å²	131	88%	0.881	71%	0.707	S	S	*	*			trans	-150.1	166.7	131.6	-167	0	0	0	0	111.6
234	K	31.5	Very low	31.3	Very low	188 Å²	188	133.2 Å²	133.2	82%	0.817	71%	0.713	S	S	*	*			trans	-127.5	119.9	-179.7	-63.8	173.3	-176.3	168.4	0	110.8
235	F	35.1	Very low	31.8	Very low	187 Å²	187	131.8 Å²	131.8	82%	0.82	71%	0.714	S	S	*	*			trans	-169.3	112	142.7	-87.2	-61.6	0	0	0	106.8
236	R	27.6	Very low	31.9	Very low	117 Å²	117	130 Å²	130	44%	0.442	70%	0.704	S	S	.	*				74	97.4	79.5	-172.5	-169.5	179.9	-169	-2.1	112.6	L169 N171	L169-R236 HydrophobicContact CD1-CB 4.36Å; L169-R236 HydrophobicContact CD1-CG 4.06Å; L169-R236 WeakPolarHBondContact CD1-O 3.47Å; L169-R236 HydrophobicContact CD2-CG 4.02Å; L169-R236 VanDerWaalsContact CD2-NE 3.27Å; N171-R236 VanDerWaalsContact CG-NH2 3.33Å; N171-R236 PolarHBondContact OD1-NH2 2.72Å
237	N	32.2	Very low	32.4	Very low	108 Å²	108	124.8 Å²	124.8	58%	0.578	69%	0.688	S	S	*	*				-158.9	154.5	125.1	-132.5	-1.3	0	0	0	111.6	L169	L169-N237 VanDerWaalsContact CD2-OD1 3.22Å; L169-N237 WeakPolarHBondContact CD2-OD1 3.26Å; L169-N237 WeakPolarHBondContact CG-OD1 3.36Å
238	A	33.9	Very low	33.2	Very low	82 Å²	82	122.2 Å²	122.2	68%	0.678	68%	0.68	S	S	*	*			trans	-149.1	124.2	171.6	0	0	0	0	0	109.4
239	N	34.9	Very low	33.5	Very low	171 Å²	171	125.3 Å²	125.3	91%	0.914	69%	0.692	S	S	*	*			trans	-174.7	144.5	162.1	-97.2	-29.2	0	0	0	109.3
240	G	29.2	Very low	34.2	Very low	62 Å²	62	123.3 Å²	123.3	64%	0.639	68%	0.683	S	S	*	*			trans	89.4	82.3	178.3	0	0	0	0	0	113.5
241	T	29.9	Very low	35.3	Very low	132 Å²	132	128.6 Å²	128.6	81%	0.81	70%	0.699	S	S	*	*				73.6	108.7	60	72.8	0	0	0	0	116.5
242	K	31.4	Very low	35.7	Very low	177 Å²	177	128.8 Å²	128.8	77%	0.77	70%	0.695	S	S	*	*			trans	52.1	105.8	148.2	-60.8	-178.1	178	-176.4	0	118.6
243	N	37.9	Very low	36.3	Very low	164 Å²	164	126 Å²	126	88%	0.877	69%	0.687	S	S	*	*				-103.1	114.8	124.9	-87.3	-8.3	0	0	0	107.8
244	I	33.7	Very low	36.9	Very low	135 Å²	135	126.7 Å²	126.7	69%	0.692	67%	0.673	S	S	*	*			trans	-138.8	95.5	165.4	-59.3	179.3	0	0	0	106.1
245	L	36.1	Very low	37.1	Very low	166 Å²	166	123 Å²	123	87%	0.869	67%	0.671	S	S	*	*			trans	-110.2	143.5	148.7	-72.1	85.6	0	0	0	106.5
246	G	32.3	Very low	37	Very low	55 Å²	55	118 Å²	118	57%	0.567	66%	0.655	S	S	*	*			cis	147.2	-1.3	-4.1	0	0	0	0	0	115.7
247	S	40	Very low	37.4	Very low	76 Å²	76	116.3 Å²	116.3	53%	0.531	66%	0.659	S	S	.	*			trans	-71.7	146.6	177.3	55.7	0	0	0	0	112.6	D249 Q250	S247-D249 VanDerWaalsContact C-N 3.26Å; S247-D249 PolarHBondContact O-N 3.03Å; S247-Q250 PolarHBondContact O-N 2.9Å
248	D	44.5	Very low	37.9	Very low	129 Å²	129	116.3 Å²	116.3	69%	0.69	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-12.5	-171.6	-85.6	-55.3	0	0	0	115	Q250 F251	D248-Q250 PolarHBondContact O-N 3.49Å; D248-F251 PolarHBondContact O-N 3.03Å
249	D	42.9	Very low	38.2	Very low	98 Å²	98	120.9 Å²	120.9	52%	0.524	67%	0.672	S	S	.	*	H	α-helix	trans	-56.9	-23	173.3	-61.7	-60.5	0	0	0	113.1	S247 F251 L252 N253	S247-D249 VanDerWaalsContact C-N 3.26Å; S247-D249 PolarHBondContact O-N 3.03Å; D249-F251 PolarHBondContact O-N 3.07Å; D249-F251 VanDerWaalsContact O-N 3.1Å; D249-L252 PolarHBondContact O-N 3.1Å; D249-N253 PolarHBondContact O-N 3.19Å
250	Q	46.8	Very low	38.6	Very low	105 Å²	105	118.3 Å²	118.3	49%	0.491	66%	0.658	S	S	.	*	H	α-helix	trans	-62.8	-12.3	172.4	-66.9	-158.3	20.4	0	0	114.2	S247 D248 K254	S247-Q250 PolarHBondContact O-N 2.9Å; D248-Q250 PolarHBondContact O-N 3.49Å; Q250-K254 WeakPolarHBondContact O-CG 3.29Å; Q250-K254 PolarHBondContact O-NZ 2.87Å
251	F	49	Very low	39.7	Very low	136 Å²	136	124.3 Å²	124.3	60%	0.596	67%	0.67	S	S	*	*	H	α-helix	trans	-84.6	-38.7	168.2	-85.6	-80.6	0	0	0	112.8	D248 D249 N253 K254	D248-F251 PolarHBondContact O-N 3.03Å; D249-F251 PolarHBondContact O-N 3.07Å; D249-F251 VanDerWaalsContact O-N 3.1Å; F251-N253 VanDerWaalsContact C-N 3.34Å; F251-N253 PolarHBondContact O-N 2.94Å; F251-K254 PolarHBondContact O-N 3.1Å; F251-K254 VanDerWaalsContact O-N 3.1Å
252	L	41.5	Very low	40.8	Very low	113 Å²	113	125.8 Å²	125.8	59%	0.592	67%	0.673	S	S	*	*	H	α-helix	trans	-64	-40.2	174.4	-71.2	172.5	0	0	0	111.3	D249 K254 C255 V256	D249-L252 PolarHBondContact O-N 3.1Å; L252-K254 PolarHBondContact O-N 3.02Å; L252-C255 WeakPolarHBondContact O-CA 3.48Å; L252-C255 PolarHBondContact O-N 2.75Å; L252-V256 PolarHBondContact O-N 2.9Å
253	N	41.6	Very low	41.2	Very low	120 Å²	120	117.9 Å²	117.9	64%	0.642	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	1.5	173.8	-72.1	-16.3	0	0	0	114.9	D249 F251	D249-N253 PolarHBondContact O-N 3.19Å; F251-N253 VanDerWaalsContact C-N 3.34Å; F251-N253 PolarHBondContact O-N 2.94Å
254	K	42.4	Very low	41.8	Very low	139 Å²	139	118.1 Å²	118.1	60%	0.604	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	-11.8	166.7	-64.5	176.6	-173.1	97.1	0	113	Q250 F251 L252	Q250-K254 WeakPolarHBondContact O-CG 3.29Å; Q250-K254 PolarHBondContact O-NZ 2.87Å; F251-K254 PolarHBondContact O-N 3.1Å; F251-K254 VanDerWaalsContact O-N 3.1Å; L252-K254 PolarHBondContact O-N 3.02Å
255	C	36.2	Very low	42.5	Very low	112 Å²	112	118.4 Å²	118.4	76%	0.757	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-33.7	174.3	-75	0	0	0	0	112.3	L252	L252-C255 WeakPolarHBondContact O-CA 3.48Å; L252-C255 PolarHBondContact O-N 2.75Å
256	V	33.4	Very low	43.3	Very low	82 Å²	82	116 Å²	116	50%	0.497	63%	0.628	S	S	.	*	S	Bend	trans	-64.5	124.7	158.8	-176.6	0	0	0	0	107.6	L252	L252-V256 PolarHBondContact O-N 2.9Å
257	P	36.6	Very low	44	Very low	81 Å²	81	116.8 Å²	116.8	53%	0.526	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-67.9	140.9	170.2	29.9	-32.7	0	0	0	108.9
258	P	41.8	Very low	44.6	Very low	107 Å²	107	118.6 Å²	118.6	70%	0.695	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-59.4	146.9	-178.3	27	-35.8	0	0	0	111	D260	P258-D260 PolarHBondContact O-N 3.43Å; P258-D260 VanDerWaalsContact O-N 3.09Å
259	E	40	Very low	45.1	Very low	178 Å²	178	117.5 Å²	117.5	83%	0.832	61%	0.614	S	S	*	*			trans	-70.7	102	177	-59.9	-174.3	150.1	0	0	109	E261	E259-E261 PolarHBondContact O-N 2.78Å; E259-E261 VanDerWaalsContact O-N 3.17Å
260	D	43.2	Very low	45.8	Very low	117 Å²	117	117.5 Å²	117.5	63%	0.626	61%	0.61	S	S	*	*			trans	-71.3	104.9	170.7	-77.5	-41.9	0	0	0	107.2	P258 N262 G263	P258-D260 PolarHBondContact O-N 3.43Å; P258-D260 VanDerWaalsContact O-N 3.09Å; D260-N262 PolarHBondContact O-N 3.22Å; D260-G263 WeakPolarHBondContact O-CA 3.35Å; D260-G263 PolarHBondContact O-N 3.48Å
261	E	51.9	Low	46	Very low	189 Å²	189	118.1 Å²	118.1	88%	0.883	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	1.7	-173.4	-60.2	176.5	145.1	0	0	116.7	E259	E259-E261 PolarHBondContact O-N 2.78Å; E259-E261 VanDerWaalsContact O-N 3.17Å
262	N	53.3	Low	46.5	Very low	163 Å²	163	120 Å²	120	87%	0.872	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.1	22.4	179.3	-71.8	-106.6	0	0	0	111.7	D260	D260-N262 PolarHBondContact O-N 3.22Å
263	G	41.2	Very low	47.4	Very low	11 Å²	11	116.3 Å²	116.3	11%	0.113	60%	0.604	C	S	.	*			trans	-108.7	-15.1	-163.1	0	0	0	0	0	118.3	D260 L265 N266 H267	D260-G263 WeakPolarHBondContact O-CA 3.35Å; D260-G263 PolarHBondContact O-N 3.48Å; G263-L265 PolarHBondContact O-N 3.03Å; G263-L265 VanDerWaalsContact O-N 3.12Å; G263-N266 WeakPolarHBondContact O-CB 3.49Å; G263-N266 PolarHBondContact O-N 3.37Å; G263-H267 VanDerWaalsContact C-CD2 3.46Å; G263-H267 PolarHBondContact O-CD2 3.27Å; G263-H267 PolarHBondContact O-N 2.85Å
264	E	49.1	Very low	48.1	Very low	168 Å²	168	116 Å²	116	79%	0.785	59%	0.594	S	S	*	*	H	α-helix	trans	-44.4	-52	-163.3	-61.1	-173.7	150.2	0	0	115.8	N266 H267 L268	E264-N266 PolarHBondContact O-N 2.92Å; E264-H267 WeakPolarHBondContact O-CB 3.23Å; E264-H267 PolarHBondContact O-N 3.49Å; E264-L268 PolarHBondContact O-N 3.16Å
265	L	48.1	Very low	48.6	Very low	141 Å²	141	114 Å²	114	74%	0.738	59%	0.587	S	S	*	*	H	α-helix	trans	-64.9	-21.3	-178	-76.9	165.9	0	0	0	114	G263 N269	G263-L265 PolarHBondContact O-N 3.03Å; G263-L265 VanDerWaalsContact O-N 3.12Å; L265-N269 PolarHBondContact O-ND2 3.49Å
266	N	53	Low	49.7	Very low	117 Å²	117	114.9 Å²	114.9	63%	0.626	58%	0.58	S	S	*	*	H	α-helix	trans	-83.5	-31.5	170.7	-79.6	-48.8	0	0	0	112.1	G263 E264 L268 N269 E270	G263-N266 WeakPolarHBondContact O-CB 3.49Å; G263-N266 PolarHBondContact O-N 3.37Å; E264-N266 PolarHBondContact O-N 2.92Å; N266-L268 PolarHBondContact O-N 2.81Å; N266-N269 PolarHBondContact O-N 3.33Å; N266-E270 PolarHBondContact O-N 3.45Å
267	H	47	Very low	51	Low	71 Å²	71	117.9 Å²	117.9	33%	0.329	59%	0.589	S	S	.	*	H	α-helix	trans	-64.8	-38.6	177.5	-63.3	-53.5	0	0	0	111.9	G263 E264 N269 E270 F271	G263-H267 VanDerWaalsContact C-CD2 3.46Å; G263-H267 PolarHBondContact O-CD2 3.27Å; G263-H267 PolarHBondContact O-N 2.85Å; E264-H267 WeakPolarHBondContact O-CB 3.23Å; E264-H267 PolarHBondContact O-N 3.49Å; H267-N269 VanDerWaalsContact C-N 3.34Å; H267-N269 PolarHBondContact O-N 3.45Å; H267-E270 PolarHBondContact O-N 3.36Å; H267-F271 VanDerWaalsContact O-CB 3.23Å; H267-F271 WeakPolarHBondContact O-CB 3.18Å; H267-F271 PolarHBondContact O-N 2.96Å
268	L	53.4	Low	52.2	Low	114 Å²	114	119.4 Å²	119.4	60%	0.597	59%	0.589	S	S	*	*	H	α-helix	trans	-61.1	-38.9	172.7	-104	166	0	0	0	113.2	E264 N266 R272	E264-L268 PolarHBondContact O-N 3.16Å; N266-L268 PolarHBondContact O-N 2.81Å; L268-R272 WeakPolarHBondContact O-CB 3.24Å; L268-R272 PolarHBondContact O-N 3.3Å
269	N	54.3	Low	52.9	Low	105 Å²	105	118.5 Å²	118.5	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-74.3	-39.2	177	-76.8	-62.8	0	0	0	112.4	L265 N266 H267 G273	L265-N269 PolarHBondContact O-ND2 3.49Å; N266-N269 PolarHBondContact O-N 3.33Å; H267-N269 VanDerWaalsContact C-N 3.34Å; H267-N269 PolarHBondContact O-N 3.45Å; N269-G273 PolarHBondContact O-N 2.99Å
270	E	59	Low	53.4	Low	98 Å²	98	116.2 Å²	116.2	46%	0.458	57%	0.572	S	S	.	*	H	α-helix	trans	-65.7	-35.9	170.5	-81.3	-154.9	169.4	0	0	112.3	N266 H267 G273 R274	N266-E270 PolarHBondContact O-N 3.45Å; H267-E270 PolarHBondContact O-N 3.36Å; E270-G273 PolarHBondContact O-N 3.42Å; E270-R274 WeakPolarHBondContact O-CB 3.33Å; E270-R274 VanDerWaalsContact O-CG 3.24Å; E270-R274 WeakPolarHBondContact O-CG 3.06Å; E270-R274 PolarHBondContact O-N 3.44Å; E270-R274 IonicContact OE2-CZ 3.78Å; E270-R274 IonicContact OE2-NE 3.09Å; E270-R274 IonicContact OE2-NH2 3.34Å; E270-R274 PolarHBondContact OE2-NH2 2.7Å
271	F	50.5	Low	53.9	Low	119 Å²	119	112.3 Å²	112.3	52%	0.522	56%	0.556	S	S	.	*	H	α-helix	trans	-69.6	-45.6	178.7	-171.9	-92.6	0	0	0	111.1	H267 G273 R274 Q275	H267-F271 VanDerWaalsContact O-CB 3.23Å; H267-F271 WeakPolarHBondContact O-CB 3.18Å; H267-F271 PolarHBondContact O-N 2.96Å; F271-G273 VanDerWaalsContact C-N 3.28Å; F271-G273 PolarHBondContact O-N 3.4Å; F271-R274 PolarHBondContact O-N 2.91Å; F271-R274 VanDerWaalsContact O-N 3.17Å; F271-Q275 HydrophobicContact CD1-CG 4.2Å; F271-Q275 HydrophobicContact CE1-CG 3.81Å; F271-Q275 HydrophobicContact CZ-CG 4.27Å; F271-Q275 WeakPolarHBondContact O-CB 3.48Å; F271-Q275 PolarHBondContact O-N 2.89Å
272	R	59	Low	53.8	Low	175 Å²	175	107.5 Å²	107.5	66%	0.66	54%	0.536	S	S	*	.	H	α-helix	trans	-58.6	-40.9	171.1	-172.4	177.9	-64.8	-169.8	-0.1	111.5	L268 Q276	L268-R272 WeakPolarHBondContact O-CB 3.24Å; L268-R272 PolarHBondContact O-N 3.3Å; R272-Q276 WeakPolarHBondContact O-CB 3.07Å; R272-Q276 PolarHBondContact O-N 2.87Å
273	G	59.7	Low	53.3	Low	36 Å²	36	107.6 Å²	107.6	37%	0.371	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-40.5	174	0	0	0	0	0	113.6	N269 E270 F271 Q276 E277	N269-G273 PolarHBondContact O-N 2.99Å; E270-G273 PolarHBondContact O-N 3.42Å; F271-G273 VanDerWaalsContact C-N 3.28Å; F271-G273 PolarHBondContact O-N 3.4Å; G273-Q276 PolarHBondContact O-N 3.17Å; G273-E277 WeakPolarHBondContact O-CB 3.39Å; G273-E277 PolarHBondContact O-N 2.93Å
274	R	57	Low	53.7	Low	114 Å²	114	113.7 Å²	113.7	43%	0.43	55%	0.549	S	S	.	.	H	α-helix	trans	-66.5	-50	175.9	-76.3	174	-130.2	172	0.4	111.7	E270 F271 Q276 E277 E278	E270-R274 WeakPolarHBondContact O-CB 3.33Å; E270-R274 VanDerWaalsContact O-CG 3.24Å; E270-R274 WeakPolarHBondContact O-CG 3.06Å; E270-R274 PolarHBondContact O-N 3.44Å; E270-R274 IonicContact OE2-CZ 3.78Å; E270-R274 IonicContact OE2-NE 3.09Å; E270-R274 IonicContact OE2-NH2 3.34Å; E270-R274 PolarHBondContact OE2-NH2 2.7Å; F271-R274 PolarHBondContact O-N 2.91Å; F271-R274 VanDerWaalsContact O-N 3.17Å; R274-Q276 VanDerWaalsContact C-N 3.25Å; R274-Q276 PolarHBondContact O-N 3.01Å; R274-E277 CarbonylContact O-C 3.52Å; R274-E277 PolarHBondContact O-N 3Å; R274-E277 VanDerWaalsContact O-N 3.11Å; R274-E278 VanDerWaalsContact O-CB 3.29Å; R274-E278 WeakPolarHBondContact O-CB 3.46Å; R274-E278 PolarHBondContact O-N 2.83Å
275	Q	52.2	Low	53.4	Low	97 Å²	97	113 Å²	113	45%	0.453	54%	0.54	S	S	.	.	H	α-helix	trans	-54	-42.8	172.9	-84.6	-84.6	-34.1	0	0	111.3	F271 E278 V279	F271-Q275 HydrophobicContact CD1-CG 4.2Å; F271-Q275 HydrophobicContact CE1-CG 3.81Å; F271-Q275 HydrophobicContact CZ-CG 4.27Å; F271-Q275 WeakPolarHBondContact O-CB 3.48Å; F271-Q275 PolarHBondContact O-N 2.89Å; Q275-E278 PolarHBondContact O-N 2.69Å; Q275-V279 WeakPolarHBondContact O-CB 3.5Å; Q275-V279 VanDerWaalsContact O-CG2 3.28Å; Q275-V279 WeakPolarHBondContact O-CG2 3.43Å; Q275-V279 PolarHBondContact O-N 2.82Å
276	Q	59	Low	53.3	Low	129 Å²	129	112.9 Å²	112.9	60%	0.603	54%	0.54	S	S	*	.	H	α-helix	trans	-71	-36	176.5	-166	172.9	18.7	0	0	113.3	R272 G273 R274 M280	R272-Q276 WeakPolarHBondContact O-CB 3.07Å; R272-Q276 PolarHBondContact O-N 2.87Å; G273-Q276 PolarHBondContact O-N 3.17Å; R274-Q276 VanDerWaalsContact C-N 3.25Å; R274-Q276 PolarHBondContact O-N 3.01Å; Q276-M280 VanDerWaalsContact O-CB 3.28Å; Q276-M280 WeakPolarHBondContact O-CB 3.41Å; Q276-M280 VanDerWaalsContact O-CG 3.29Å; Q276-M280 WeakPolarHBondContact O-CG 3.48Å; Q276-M280 PolarHBondContact O-N 3.4Å
277	E	62.2	Low	52.3	Low	146 Å²	146	111 Å²	111	68%	0.682	54%	0.535	S	S	*	.	H	α-helix	trans	-68.5	-35.2	173.8	-172.8	169.6	-156.6	0	0	111.7	G273 R274 A281	G273-E277 WeakPolarHBondContact O-CB 3.39Å; G273-E277 PolarHBondContact O-N 2.93Å; R274-E277 CarbonylContact O-C 3.52Å; R274-E277 PolarHBondContact O-N 3Å; R274-E277 VanDerWaalsContact O-N 3.11Å; E277-A281 VanDerWaalsContact O-CB 3.29Å; E277-A281 WeakPolarHBondContact O-CB 3.49Å; E277-A281 PolarHBondContact O-N 3.4Å
278	E	61.8	Low	51.8	Low	113 Å²	113	112 Å²	112	53%	0.528	54%	0.542	S	S	.	.	H	α-helix	trans	-73.5	-46.1	177	-175.8	159.7	-141.3	0	0	112	R274 Q275 M280 A281 N282	R274-E278 VanDerWaalsContact O-CB 3.29Å; R274-E278 WeakPolarHBondContact O-CB 3.46Å; R274-E278 PolarHBondContact O-N 2.83Å; Q275-E278 PolarHBondContact O-N 2.69Å; E278-M280 VanDerWaalsContact C-N 3.3Å; E278-M280 PolarHBondContact O-N 2.74Å; E278-A281 WeakPolarHBondContact O-CB 3.29Å; E278-A281 PolarHBondContact O-N 3.35Å; E278-A281 VanDerWaalsContact O-N 3.11Å; E278-N282 WeakPolarHBondContact O-CB 3.41Å; E278-N282 VanDerWaalsContact O-CG 3.32Å; E278-N282 PolarHBondContact O-N 2.99Å
279	V	55.6	Low	50.9	Low	88 Å²	88	113.3 Å²	113.3	53%	0.533	55%	0.545	S	S	.	.	H	α-helix	trans	-60	-40.2	170.2	169.7	0	0	0	0	110.8	Q275 Y283	Q275-V279 WeakPolarHBondContact O-CB 3.5Å; Q275-V279 VanDerWaalsContact O-CG2 3.28Å; Q275-V279 WeakPolarHBondContact O-CG2 3.43Å; Q275-V279 PolarHBondContact O-N 2.82Å; V279-Y283 WeakPolarHBondContact O-CB 3.32Å; V279-Y283 PolarHBondContact O-N 2.99Å
280	M	51.4	Low	50.2	Low	130 Å²	130	111.7 Å²	111.7	64%	0.64	54%	0.54	S	S	*	.	H	α-helix	trans	-71.6	-28.8	173.8	-75.9	-135.4	-60.9	0	0	113.7	Q276 E278 K284	Q276-M280 VanDerWaalsContact O-CB 3.28Å; Q276-M280 WeakPolarHBondContact O-CB 3.41Å; Q276-M280 VanDerWaalsContact O-CG 3.29Å; Q276-M280 WeakPolarHBondContact O-CG 3.48Å; Q276-M280 PolarHBondContact O-N 3.4Å; E278-M280 VanDerWaalsContact C-N 3.3Å; E278-M280 PolarHBondContact O-N 2.74Å; M280-K284 WeakPolarHBondContact O-CB 3.42Å; M280-K284 PolarHBondContact O-N 2.94Å
281	A	53.7	Low	49	Very low	34 Å²	34	114.7 Å²	114.7	28%	0.281	55%	0.554	S	S	.	*	H	α-helix	trans	-67.6	-52.5	171.7	0	0	0	0	0	109.9	E277 E278 Y283 K284 Y285	E277-A281 VanDerWaalsContact O-CB 3.29Å; E277-A281 WeakPolarHBondContact O-CB 3.49Å; E277-A281 PolarHBondContact O-N 3.4Å; E278-A281 WeakPolarHBondContact O-CB 3.29Å; E278-A281 PolarHBondContact O-N 3.35Å; E278-A281 VanDerWaalsContact O-N 3.11Å; A281-Y283 PolarHBondContact O-N 2.97Å; A281-K284 CarbonylContact O-C 3.46Å; A281-K284 WeakPolarHBondContact O-CA 3.44Å; A281-K284 WeakPolarHBondContact O-CB 3.47Å; A281-K284 PolarHBondContact O-N 3.01Å; A281-Y285 WeakPolarHBondContact O-CD2 3.37Å; A281-Y285 PolarHBondContact O-N 3.39Å
282	N	50.1	Low	48.1	Very low	89 Å²	89	112.4 Å²	112.4	48%	0.476	56%	0.564	S	S	.	*	H	α-helix	trans	-62.2	-42.4	179.3	-66.3	-9.4	0	0	0	111.2	E278 K284 Y285 N286	E278-N282 WeakPolarHBondContact O-CB 3.41Å; E278-N282 VanDerWaalsContact O-CG 3.32Å; E278-N282 PolarHBondContact O-N 2.99Å; N282-K284 VanDerWaalsContact C-N 3.31Å; N282-K284 PolarHBondContact O-N 3.17Å; N282-Y285 PolarHBondContact O-N 3.48Å; N282-N286 WeakPolarHBondContact O-CB 3.23Å; N282-N286 VanDerWaalsContact O-CG 3.26Å; N282-N286 PolarHBondContact O-N 2.9Å; N282-N286 PolarHBondContact O-OD1 3.16Å
283	Y	41.3	Very low	47.1	Very low	164 Å²	164	112.3 Å²	112.3	64%	0.643	56%	0.564	S	S	*	*	H	α-helix	trans	-60.7	-39.6	171.5	-168.4	-90.5	0	0	0	111.9	V279 A281 C287	V279-Y283 WeakPolarHBondContact O-CB 3.32Å; V279-Y283 PolarHBondContact O-N 2.99Å; A281-Y283 PolarHBondContact O-N 2.97Å; Y283-C287 HydrophobicContact CE1-CB 4.36Å; Y283-C287 WeakPolarHBondContact O-CB 3.48Å; Y283-C287 PolarHBondContact O-N 3.32Å; Y283-C287 PolarHBondContact O-SG 3.29Å; Y283-C287 VanDerWaalsContact O-SG 3.37Å
284	K	49.7	Very low	46	Very low	140 Å²	140	112.9 Å²	112.9	61%	0.609	56%	0.561	S	S	*	*	H	α-helix	trans	-70.8	-31.5	176.6	-175	174.5	-179	179.4	0	113.2	M280 A281 N282 I288	M280-K284 WeakPolarHBondContact O-CB 3.42Å; M280-K284 PolarHBondContact O-N 2.94Å; A281-K284 CarbonylContact O-C 3.46Å; A281-K284 WeakPolarHBondContact O-CA 3.44Å; A281-K284 WeakPolarHBondContact O-CB 3.47Å; A281-K284 PolarHBondContact O-N 3.01Å; N282-K284 VanDerWaalsContact C-N 3.31Å; N282-K284 PolarHBondContact O-N 3.17Å; K284-I288 HydrophobicContact CG-CD1 4.35Å; K284-I288 VanDerWaalsContact O-CD1 3.31Å; K284-I288 WeakPolarHBondContact O-CD1 3.23Å; K284-I288 WeakPolarHBondContact O-CG1 3.46Å; K284-I288 PolarHBondContact O-N 3.38Å; K284-I288 VanDerWaalsContact O-N 3.11Å
285	Y	42.8	Very low	45.5	Very low	154 Å²	154	114.3 Å²	114.3	60%	0.604	58%	0.577	S	S	*	*	H	α-helix	trans	-77.5	-38.7	174.9	-76.1	-68.2	0	0	0	111.7	A281 N282 I288	A281-Y285 WeakPolarHBondContact O-CD2 3.37Å; A281-Y285 PolarHBondContact O-N 3.39Å; N282-Y285 PolarHBondContact O-N 3.48Å; Y285-I288 PolarHBondContact O-N 3.46Å
286	N	46	Very low	44.8	Very low	138 Å²	138	113.5 Å²	113.5	74%	0.738	58%	0.576	S	S	*	*	H	α-helix	trans	-72.8	-27.1	175.3	-66.6	5.2	0	0	0	113.1	N282	N282-N286 WeakPolarHBondContact O-CB 3.23Å; N282-N286 VanDerWaalsContact O-CG 3.26Å; N282-N286 PolarHBondContact O-N 2.9Å; N282-N286 PolarHBondContact O-OD1 3.16Å
287	C	32.7	Very low	44	Very low	77 Å²	77	115.9 Å²	115.9	52%	0.52	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99	4.5	175.4	-62.3	0	0	0	0	114.2	Y283 E289	Y283-C287 HydrophobicContact CE1-CB 4.36Å; Y283-C287 WeakPolarHBondContact O-CB 3.48Å; Y283-C287 PolarHBondContact O-N 3.32Å; Y283-C287 PolarHBondContact O-SG 3.29Å; Y283-C287 VanDerWaalsContact O-SG 3.37Å; C287-E289 PolarHBondContact O-N 3.49Å
288	I	35.6	Very low	43	Very low	91 Å²	91	117.7 Å²	117.7	47%	0.467	59%	0.588	S	S	.	*	S	Bend	trans	-79.3	100.5	153.5	-75	161.1	0	0	0	105.3	K284 Y285	K284-I288 HydrophobicContact CG-CD1 4.35Å; K284-I288 VanDerWaalsContact O-CD1 3.31Å; K284-I288 WeakPolarHBondContact O-CD1 3.23Å; K284-I288 WeakPolarHBondContact O-CG1 3.46Å; K284-I288 PolarHBondContact O-N 3.38Å; K284-I288 VanDerWaalsContact O-N 3.11Å; Y285-I288 PolarHBondContact O-N 3.46Å
289	E	34.6	Very low	42.1	Very low	143 Å²	143	113 Å²	113	67%	0.668	57%	0.568	S	S	*	*			trans	-38.1	125.1	156	-102.8	176.4	-169.5	0	0	107.6	C287 Q291	C287-E289 PolarHBondContact O-N 3.49Å; E289-Q291 PolarHBondContact O-N 3.07Å; E289-Q291 PolarHBondContact OE2-NE2 2.93Å
290	P	41.2	Very low	41.8	Very low	70 Å²	70	111.9 Å²	111.9	46%	0.455	56%	0.561	S	S	.	*			trans	-73.3	58.3	-169.2	27.4	-34.7	0	0	0	112.8	G292 W293	P290-G292 PolarHBondContact O-N 3.29Å; P290-W293 HydrophobicContact CB-CB 4.31Å; P290-W293 VanDerWaalsContact CB-CD1 3.5Å; P290-W293 HydrophobicContact CB-CG 3.93Å; P290-W293 WeakPolarHBondContact O-CB 3.3Å; P290-W293 PolarHBondContact O-N 3.19Å
291	Q	34	Very low	41.1	Very low	161 Å²	161	111.3 Å²	111.3	75%	0.752	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	24.5	-168	-151.8	154.3	96.3	0	0	114.2	E289	E289-Q291 PolarHBondContact O-N 3.07Å; E289-Q291 PolarHBondContact OE2-NE2 2.93Å
292	G	31.6	Very low	40	Very low	71 Å²	71	111.8 Å²	111.8	73%	0.732	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	-13	168.9	0	0	0	0	0	113.3	P290	P290-G292 PolarHBondContact O-N 3.29Å
293	W	37.4	Very low	39.2	Very low	174 Å²	174	109.2 Å²	109.2	66%	0.659	56%	0.563	S	S	*	*	S	Bend	trans	-69.5	149.1	160.5	-66.2	55.9	0	0	0	108.1	P290	P290-W293 HydrophobicContact CB-CB 4.31Å; P290-W293 VanDerWaalsContact CB-CD1 3.5Å; P290-W293 HydrophobicContact CB-CG 3.93Å; P290-W293 WeakPolarHBondContact O-CB 3.3Å; P290-W293 PolarHBondContact O-N 3.19Å
294	P	35.7	Very low	39	Very low	48 Å²	48	108.3 Å²	108.3	31%	0.312	57%	0.569	S	S	.	*			trans	-75.5	119.7	163.3	29.5	-28.9	0	0	0	109.3	D296 A299 N845	P294-D296 PolarHBondContact O-N 3.27Å; P294-D296 VanDerWaalsContact O-N 3.14Å; P294-A299 HydrophobicContact CG-CB 4.21Å; P294-N845 WeakPolarHBondContact CB-ND2 3.46Å
295	D	48	Very low	39	Very low	143 Å²	143	105.9 Å²	105.9	77%	0.765	58%	0.575	S	S	*	*	S	Bend	trans	-66.1	-8.8	172.3	-52.8	-67	0	0	0	112.7	E297	D295-E297 PolarHBondContact O-N 3.24Å
296	D	36.3	Very low	38.9	Very low	80 Å²	80	107.4 Å²	107.4	43%	0.428	59%	0.587	S	S	.	*			trans	-78.9	96.5	170.1	-75.9	-67.6	0	0	0	110.7	P294 R298 A299	P294-D296 PolarHBondContact O-N 3.27Å; P294-D296 VanDerWaalsContact O-N 3.14Å; D296-R298 HydrophobicContact CB-CB 4.21Å; D296-R298 CarbonylContact O-C 3.42Å; D296-R298 PolarHBondContact O-N 3.25Å; D296-A299 WeakPolarHBondContact O-CB 3.29Å; D296-A299 PolarHBondContact O-N 2.98Å
297	E	43	Very low	38.6	Very low	179 Å²	179	107.3 Å²	107.3	84%	0.836	59%	0.587	S	S	*	*	S	Bend	trans	-59.5	-12	159.2	-67.7	-175.4	151	0	0	112.2	D295 A299	D295-E297 PolarHBondContact O-N 3.24Å; E297-A299 PolarHBondContact O-N 3.46Å
298	R	40.9	Very low	39.3	Very low	185 Å²	185	108.9 Å²	108.9	70%	0.698	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	34.8	155.5	-61.2	-176.4	174.1	-145.5	-4.9	112.4	D296 S844 K846	D296-R298 HydrophobicContact CB-CB 4.21Å; D296-R298 CarbonylContact O-C 3.42Å; D296-R298 PolarHBondContact O-N 3.25Å; R298-S844 PolarHBondContact O-OG 3.02Å; R298-K846 WeakPolarHBondContact O-CD 3.44Å; R298-K846 WeakPolarHBondContact O-CE 3.41Å
299	A	43.1	Very low	39.5	Very low	13 Å²	13	113.5 Å²	113.5	11%	0.107	60%	0.604	C	S	.	*	T	Hydrogen-bonded Turn	trans	-116.8	1.5	174.5	0	0	0	0	0	115	P294 D296 E297 N845 K846	P294-A299 HydrophobicContact CG-CB 4.21Å; D296-A299 WeakPolarHBondContact O-CB 3.29Å; D296-A299 PolarHBondContact O-N 2.98Å; E297-A299 PolarHBondContact O-N 3.46Å; A299-N845 VanDerWaalsContact CA-CB 3.45Å; A299-N845 HydrophobicContact CB-CB 3.42Å; A299-N845 VanDerWaalsContact CB-CB 3.42Å; A299-K846 VanDerWaalsContact O-CA 3.3Å; A299-K846 WeakPolarHBondContact O-CA 3.29Å
300	V	47.9	Very low	40	Very low	65 Å²	65	113.3 Å²	113.3	39%	0.394	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-127.4	-43.8	178.1	-172.7	0	0	0	0	111.6	G302	V300-G302 PolarHBondContact O-N 3.44Å
301	L	37.9	Very low	40.6	Very low	119 Å²	119	111.1 Å²	111.1	62%	0.623	59%	0.589	S	S	*	*	S	Bend	trans	-94.5	73	-169	-57.1	177.5	0	0	0	114.7	K846	L301-K846 VanDerWaalsContact C-CE 3.42Å; L301-K846 WeakPolarHBondContact O-CE 3.42Å; L301-K846 PolarHBondContact O-NZ 3.26Å
302	G	29.8	Very low	41.4	Very low	44 Å²	44	104.6 Å²	104.6	45%	0.454	57%	0.565	S	S	.	*			trans	158.2	46.7	168.8	0	0	0	0	0	119.1	V300	V300-G302 PolarHBondContact O-N 3.44Å
303	G	33	Very low	42.4	Very low	34 Å²	34	109 Å²	109	35%	0.351	57%	0.566	S	S	.	*	S	Bend		-67.7	166.2	124.6	0	0	0	0	0	109.3
304	N	37.9	Very low	43.6	Very low	146 Å²	146	101.9 Å²	101.9	78%	0.781	54%	0.541	S	S	*	.			trans	-59	148.4	179.8	-86.2	-14.3	0	0	0	111.5	Q306	N304-Q306 PolarHBondContact O-N 2.89Å
305	A	48.9	Very low	44.6	Very low	88 Å²	88	103.4 Å²	103.4	73%	0.727	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	21.7	-164.8	0	0	0	0	0	115.7
306	Q	40.7	Very low	45.7	Very low	186 Å²	186	100.3 Å²	100.3	87%	0.869	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-27.2	179.7	-67.5	-175.9	-82.2	0	0	113.8	N304 K308	N304-Q306 PolarHBondContact O-N 2.89Å; Q306-K308 PolarHBondContact O-N 2.6Å; Q306-K308 VanDerWaalsContact O-N 3.13Å
307	D	41	Very low	46.8	Very low	137 Å²	137	101.2 Å²	101.2	73%	0.733	53%	0.527	S	S	*	.	S	Bend	trans	-86.8	30.2	-179.9	-62.8	-34.2	0	0	0	113.9	T311	D307-T311 PolarHBondContact O-OG1 2.77Å
308	K	46.9	Very low	48.1	Very low	110 Å²	110	96.9 Å²	96.9	48%	0.478	51%	0.506	S	S	.	.			trans	-91.1	3.5	-164.3	-89.9	-149.7	164.2	-150.2	0	116.7	Q306	Q306-K308 PolarHBondContact O-N 2.6Å; Q306-K308 VanDerWaalsContact O-N 3.13Å
309	H	39.8	Very low	49.6	Very low	187 Å²	187	92.2 Å²	92.2	87%	0.866	49%	0.493	S	S	*	.	S	Bend	trans	-103.1	-1.9	-158.8	-135.9	-59.9	0	0	0	117.8
310	E	44.2	Very low	51.1	Low	140 Å²	140	95 Å²	95	65%	0.654	51%	0.506	S	S	*	.	S	Bend	trans	-136.9	-4.5	-174	-150.8	154.9	-165	0	0	114.6
311	T	54.1	Low	52.2	Low	24 Å²	24	94.4 Å²	94.4	15%	0.147	50%	0.501	C	S	.	.			trans	-117.6	-18.9	-140.5	45.4	0	0	0	0	116.6	D307 D848 S849 D850	D307-T311 PolarHBondContact O-OG1 2.77Å; T311-D848 CarbonylContact O-C 2.99Å; T311-D848 WeakPolarHBondContact O-CA 3.39Å; T311-S849 PolarHBondContact O-N 3.12Å; T311-D850 HydrophobicContact CG2-CB 4.19Å; T311-D850 PolarHBondContact O-N 3.04Å
312	G	50.5	Low	53.8	Low	24 Å²	24	91.6 Å²	91.6	25%	0.247	50%	0.495	C	S	.	.	H	α-helix	trans	-82.9	-35.9	-168.9	0	0	0	0	0	117.5	D314 F315 D848	G312-D314 VanDerWaalsContact C-N 3.28Å; G312-D314 PolarHBondContact O-N 3.36Å; G312-F315 PolarHBondContact O-N 3.47Å; G312-D848 VanDerWaalsContact CA-CG 3.42Å; G312-D848 WeakPolarHBondContact CA-OD1 3.41Å
313	E	53.6	Low	55.9	Low	162 Å²	162	95.9 Å²	95.9	76%	0.757	50%	0.498	S	S	*	.	H	α-helix	trans	-62.3	-40	178.2	-70.8	-146.3	152.6	0	0	111.3	F315 T316 R317	E313-F315 VanDerWaalsContact C-N 3.32Å; E313-F315 PolarHBondContact O-N 2.94Å; E313-T316 PolarHBondContact O-N 3.45Å; E313-T316 PolarHBondContact O-OG1 3.2Å; E313-R317 PolarHBondContact O-N 2.64Å; E313-R317 VanDerWaalsContact O-N 3.14Å
314	D	62.9	Low	57.8	Low	25 Å²	25	95.9 Å²	95.9	13%	0.134	49%	0.49	C	S	.	.	H	α-helix	trans	-71.1	-24.8	-177.4	-118.9	-22.2	0	0	0	112.7	G312 R317 Q318 H851	G312-D314 VanDerWaalsContact C-N 3.28Å; G312-D314 PolarHBondContact O-N 3.36Å; D314-R317 PolarHBondContact O-N 2.87Å; D314-R317 WeakPolarHBondContact OD1-CD 3.49Å; D314-R317 IonicContact OD1-CZ 3.12Å; D314-R317 IonicContact OD1-NE 3.96Å; D314-R317 IonicContact OD1-NH1 3.05Å; D314-R317 PolarHBondContact OD1-NH1 3.4Å; D314-R317 IonicContact OD2-NH1 2.76Å; D314-Q318 VanDerWaalsContact O-CB 3.26Å; D314-Q318 WeakPolarHBondContact O-CB 3.37Å; D314-Q318 WeakPolarHBondContact O-CG 3.38Å; D314-Q318 PolarHBondContact O-N 3.13Å; D314-H851 PolarHBondContact OD2-N 3.49Å
315	F	56.3	Low	59.5	Low	81 Å²	81	96 Å²	96	36%	0.355	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-46.1	171.6	-176.4	-94.7	0	0	0	111.8	G312 E313 R317 Q318 M319	G312-F315 PolarHBondContact O-N 3.47Å; E313-F315 VanDerWaalsContact C-N 3.32Å; E313-F315 PolarHBondContact O-N 2.94Å; F315-R317 VanDerWaalsContact C-N 3.28Å; F315-R317 PolarHBondContact O-N 3.07Å; F315-Q318 PolarHBondContact O-N 2.85Å; F315-M319 WeakPolarHBondContact O-CB 3.29Å; F315-M319 PolarHBondContact O-N 3.11Å
316	T	70.2	Confident	60.7	Low	77 Å²	77	95.1 Å²	95.1	47%	0.472	47%	0.466	S	S	.	.	H	α-helix	trans	-63.9	-36.6	176.8	72	0	0	0	0	111.8	E313 L320	E313-T316 PolarHBondContact O-N 3.45Å; E313-T316 PolarHBondContact O-OG1 3.2Å; T316-L320 WeakPolarHBondContact O-CB 3.49Å; T316-L320 PolarHBondContact O-N 2.91Å
317	R	60.9	Low	62.1	Low	100 Å²	100	88.9 Å²	88.9	38%	0.377	44%	0.443	S	S	.	.	H	α-helix	trans	-69.5	-44.3	177.8	-177.3	169.9	166.6	-86.5	1.9	112.1	E313 D314 F315 L320 L321	E313-R317 PolarHBondContact O-N 2.64Å; E313-R317 VanDerWaalsContact O-N 3.14Å; D314-R317 PolarHBondContact O-N 2.87Å; D314-R317 WeakPolarHBondContact OD1-CD 3.49Å; D314-R317 IonicContact OD1-CZ 3.12Å; D314-R317 IonicContact OD1-NE 3.96Å; D314-R317 IonicContact OD1-NH1 3.05Å; D314-R317 PolarHBondContact OD1-NH1 3.4Å; D314-R317 IonicContact OD2-NH1 2.76Å; F315-R317 VanDerWaalsContact C-N 3.28Å; F315-R317 PolarHBondContact O-N 3.07Å; R317-L320 PolarHBondContact O-N 3.37Å; R317-L321 HydrophobicContact CG-CD1 4.18Å; R317-L321 WeakPolarHBondContact O-CB 3.46Å; R317-L321 WeakPolarHBondContact O-CD1 3.41Å; R317-L321 VanDerWaalsContact O-CG 3.31Å; R317-L321 WeakPolarHBondContact O-CG 3.45Å; R317-L321 PolarHBondContact O-N 3.42Å
318	Q	68.9	Low	63.4	Low	87 Å²	87	83.3 Å²	83.3	41%	0.407	41%	0.413	S	S	.	.	H	α-helix	trans	-63.2	-41.9	173	-75	-177.7	43.6	0	0	111.5	D314 F315 L321 A322 S849 D850	D314-Q318 VanDerWaalsContact O-CB 3.26Å; D314-Q318 WeakPolarHBondContact O-CB 3.37Å; D314-Q318 WeakPolarHBondContact O-CG 3.38Å; D314-Q318 PolarHBondContact O-N 3.13Å; F315-Q318 PolarHBondContact O-N 2.85Å; Q318-L321 PolarHBondContact O-N 2.93Å; Q318-A322 VanDerWaalsContact O-CB 3.31Å; Q318-A322 WeakPolarHBondContact O-CB 3.29Å; Q318-A322 PolarHBondContact O-N 3.41Å; Q318-S849 PolarHBondContact NE2-O 3.15Å; Q318-D850 PolarHBondContact NE2-O 3.02Å
319	M	73.9	Confident	64.5	Low	87 Å²	87	81.7 Å²	81.7	43%	0.429	41%	0.412	S	S	.	.	H	α-helix	trans	-63	-43.2	175.8	-176.7	172.7	63.1	0	0	112	F315 A322 Y323	F315-M319 WeakPolarHBondContact O-CB 3.29Å; F315-M319 PolarHBondContact O-N 3.11Å; M319-A322 PolarHBondContact O-N 2.79Å; M319-Y323 WeakPolarHBondContact O-CB 3.29Å; M319-Y323 PolarHBondContact O-N 3.32Å
320	L	74.3	Confident	66.3	Low	71 Å²	71	78.7 Å²	78.7	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-64.4	-43.2	174.8	-177.8	62.6	0	0	0	111.8	T316 R317 A322 Y323 L324 I382	T316-L320 WeakPolarHBondContact O-CB 3.49Å; T316-L320 PolarHBondContact O-N 2.91Å; R317-L320 PolarHBondContact O-N 3.37Å; L320-A322 PolarHBondContact O-N 2.92Å; L320-Y323 PolarHBondContact O-N 3.45Å; L320-L324 HydrophobicContact CD1-CD1 4.17Å; L320-L324 HydrophobicContact CD1-CG 4.37Å; L320-L324 HydrophobicContact CG-CD1 3.99Å; L320-L324 WeakPolarHBondContact O-CB 3.36Å; L320-L324 VanDerWaalsContact O-CG 3.29Å; L320-L324 WeakPolarHBondContact O-CG 3.5Å; L320-L324 PolarHBondContact O-N 3.19Å; L320-I382 HydrophobicContact CD2-CG2 4.02Å
321	L	70.4	Confident	67.7	Low	54 Å²	54	74.7 Å²	74.7	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-59.9	-43.4	173.9	-80	162.4	0	0	0	111.8	R317 Q318 L324 K325 M378 I382	R317-L321 HydrophobicContact CG-CD1 4.18Å; R317-L321 WeakPolarHBondContact O-CB 3.46Å; R317-L321 WeakPolarHBondContact O-CD1 3.41Å; R317-L321 VanDerWaalsContact O-CG 3.31Å; R317-L321 WeakPolarHBondContact O-CG 3.45Å; R317-L321 PolarHBondContact O-N 3.42Å; Q318-L321 PolarHBondContact O-N 2.93Å; L321-L324 PolarHBondContact O-N 2.88Å; L321-K325 VanDerWaalsContact O-CB 3.22Å; L321-K325 WeakPolarHBondContact O-CB 3.45Å; L321-K325 PolarHBondContact O-N 3.2Å; L321-M378 HydrophobicContact CD2-CG 3.96Å; L321-I382 HydrophobicContact CD2-CD1 3.42Å; L321-I382 VanDerWaalsContact CD2-CD1 3.42Å; L321-I382 HydrophobicContact CG-CD1 3.92Å
322	A	70.8	Confident	68.4	Low	60 Å²	60	75.2 Å²	75.2	50%	0.496	38%	0.378	S	S	.	.	H	α-helix	trans	-64.9	-44.5	177.3	0	0	0	0	0	111.8	Q318 M319 L320 K325 D326	Q318-A322 VanDerWaalsContact O-CB 3.31Å; Q318-A322 WeakPolarHBondContact O-CB 3.29Å; Q318-A322 PolarHBondContact O-N 3.41Å; M319-A322 PolarHBondContact O-N 2.79Å; L320-A322 PolarHBondContact O-N 2.92Å; A322-K325 PolarHBondContact O-N 3.35Å; A322-D326 WeakPolarHBondContact O-CB 3.49Å; A322-D326 PolarHBondContact O-N 3.11Å
323	Y	74.1	Confident	69.6	Low	134 Å²	134	77.5 Å²	77.5	53%	0.525	38%	0.384	S	S	.	.	H	α-helix	trans	-60.7	-45.5	174.6	179.3	-92.7	0	0	0	111.9	M319 L320 D326 S327	M319-Y323 WeakPolarHBondContact O-CB 3.29Å; M319-Y323 PolarHBondContact O-N 3.32Å; L320-Y323 PolarHBondContact O-N 3.45Å; Y323-D326 PolarHBondContact O-N 2.91Å; Y323-S327 VanDerWaalsContact O-CB 3.22Å; Y323-S327 WeakPolarHBondContact O-CB 3.41Å; Y323-S327 PolarHBondContact O-N 2.85Å
324	L	74.5	Confident	70.6	Confident	34 Å²	34	76 Å²	76	18%	0.178	38%	0.375	C	S	.	.	H	α-helix	trans	-66.7	-37.3	177.5	-71.1	168.4	0	0	0	111.9	L320 L321 S327 M328 M378 I382	L320-L324 HydrophobicContact CD1-CD1 4.17Å; L320-L324 HydrophobicContact CD1-CG 4.37Å; L320-L324 HydrophobicContact CG-CD1 3.99Å; L320-L324 WeakPolarHBondContact O-CB 3.36Å; L320-L324 VanDerWaalsContact O-CG 3.29Å; L320-L324 WeakPolarHBondContact O-CG 3.5Å; L320-L324 PolarHBondContact O-N 3.19Å; L321-L324 PolarHBondContact O-N 2.88Å; L324-S327 PolarHBondContact O-N 2.73Å; L324-M328 VanDerWaalsContact O-CB 3.29Å; L324-M328 WeakPolarHBondContact O-CB 3.3Å; L324-M328 WeakPolarHBondContact O-CG 3.33Å; L324-M328 PolarHBondContact O-N 3.39Å; L324-M378 HydrophobicContact CB-CE 3.54Å; L324-M378 HydrophobicContact CB-SD 3.82Å; L324-M378 HydrophobicContact CD1-SD 4.05Å; L324-M378 HydrophobicContact CG-SD 4.49Å; L324-I382 HydrophobicContact CD1-CD1 3.75Å; L324-I382 HydrophobicContact CD1-CG1 3.38Å
325	K	72.9	Confident	70.8	Confident	149 Å²	149	75.1 Å²	75.1	65%	0.648	37%	0.37	S	S	*	.	H	α-helix	trans	-67.2	-40.2	175.6	-171.5	170.8	-176.2	171.9	0	112.4	L321 A322 T329	L321-K325 VanDerWaalsContact O-CB 3.22Å; L321-K325 WeakPolarHBondContact O-CB 3.45Å; L321-K325 PolarHBondContact O-N 3.2Å; A322-K325 PolarHBondContact O-N 3.35Å; K325-T329 WeakPolarHBondContact O-CB 3.36Å; K325-T329 PolarHBondContact O-N 2.86Å; K325-T329 PolarHBondContact O-OG1 2.91Å
326	D	72.9	Confident	71.6	Confident	69 Å²	69	75.9 Å²	75.9	37%	0.369	37%	0.374	S	S	.	.	H	α-helix	trans	-67.9	-43.7	172.9	169.4	52.9	0	0	0	111.8	A322 Y323 T329 K330	A322-D326 WeakPolarHBondContact O-CB 3.49Å; A322-D326 PolarHBondContact O-N 3.11Å; Y323-D326 PolarHBondContact O-N 2.91Å; D326-T329 PolarHBondContact O-N 3.44Å; D326-K330 WeakPolarHBondContact O-CB 3.29Å; D326-K330 WeakPolarHBondContact O-CG 3.42Å; D326-K330 PolarHBondContact O-N 3.04Å; D326-K330 WeakPolarHBondContact OD1-CD 3.24Å; D326-K330 WeakPolarHBondContact OD1-CE 3.46Å; D326-K330 IonicContact OD1-NZ 2.68Å; D326-K330 PolarHBondContact OD1-NZ 3.43Å; D326-K330 IonicContact OD2-NZ 3.16Å; D326-K330 PolarHBondContact OD2-NZ 2.98Å
327	S	70.7	Confident	71.7	Confident	55 Å²	55	79.7 Å²	79.7	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-59.9	-46.5	173.7	-171.2	0	0	0	0	111.6	Y323 L324 T329 K330 W331	Y323-S327 VanDerWaalsContact O-CB 3.22Å; Y323-S327 WeakPolarHBondContact O-CB 3.41Å; Y323-S327 PolarHBondContact O-N 2.85Å; L324-S327 PolarHBondContact O-N 2.73Å; S327-T329 PolarHBondContact O-N 3.3Å; S327-K330 PolarHBondContact O-N 2.83Å; S327-W331 VanDerWaalsContact O-CB 3.23Å; S327-W331 WeakPolarHBondContact O-CB 3.35Å; S327-W331 PolarHBondContact O-N 2.92Å
328	M	67.5	Low	71.8	Confident	19 Å²	19	77.7 Å²	77.7	9%	0.094	38%	0.376	C	S	.	.	H	α-helix	trans	-57.9	-46	170.8	-87.1	-173.5	62.5	0	0	111.9	L324 W331 L332 W365 M378	L324-M328 VanDerWaalsContact O-CB 3.29Å; L324-M328 WeakPolarHBondContact O-CB 3.3Å; L324-M328 WeakPolarHBondContact O-CG 3.33Å; L324-M328 PolarHBondContact O-N 3.39Å; M328-W331 CarbonylContact O-C 3.6Å; M328-W331 PolarHBondContact O-N 3.15Å; M328-L332 HydrophobicContact CE-CD1 4.45Å; M328-L332 WeakPolarHBondContact O-CB 3.08Å; M328-L332 WeakPolarHBondContact O-CG 3.36Å; M328-L332 PolarHBondContact O-N 3.01Å; M328-W365 HydrophobicContact CE-CB 4.22Å; M328-W365 HydrophobicContact CE-CE3 4.34Å; M328-W365 VanDerWaalsContact CE-O 3.29Å; M328-W365 WeakPolarHBondContact CE-O 3.29Å; M328-W365 HydrophobicContact CG-CD2 4.26Å; M328-W365 HydrophobicContact CG-CE3 3.61Å; M328-W365 HydrophobicContact CG-CZ3 3.93Å; M328-W365 HydrophobicContact SD-CD2 4.45Å; M328-W365 HydrophobicContact SD-CE3 3.46Å; M328-W365 HydrophobicContact SD-CZ3 3.9Å; M328-M378 HydrophobicContact CG-CE 4.2Å; M328-M378 HydrophobicContact SD-CE 3.31Å; M328-M378 WeakPolarHBondContact SD-CE 3.33Å; M328-M378 HydrophobicContact SD-SD 4.34Å
329	T	71.4	Confident	71.7	Confident	76 Å²	76	79.3 Å²	79.3	47%	0.466	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-47.6	-179.2	-59.9	0	0	0	0	110.6	K325 D326 S327 W331 L332 D333	K325-T329 WeakPolarHBondContact O-CB 3.36Å; K325-T329 PolarHBondContact O-N 2.86Å; K325-T329 PolarHBondContact O-OG1 2.91Å; D326-T329 PolarHBondContact O-N 3.44Å; S327-T329 PolarHBondContact O-N 3.3Å; T329-W331 VanDerWaalsContact C-N 3.3Å; T329-W331 PolarHBondContact O-N 3.4Å; T329-L332 PolarHBondContact O-N 3.16Å; T329-D333 WeakPolarHBondContact O-CB 3.46Å; T329-D333 PolarHBondContact O-N 3.33Å
330	K	77.8	Confident	71.5	Confident	124 Å²	124	84.3 Å²	84.3	54%	0.539	40%	0.396	S	S	.	.	H	α-helix	trans	-60.8	-36.5	173.9	-74.4	164.1	173.8	159.6	0	112.4	D326 S327 K334	D326-K330 WeakPolarHBondContact O-CB 3.29Å; D326-K330 WeakPolarHBondContact O-CG 3.42Å; D326-K330 PolarHBondContact O-N 3.04Å; D326-K330 WeakPolarHBondContact OD1-CD 3.24Å; D326-K330 WeakPolarHBondContact OD1-CE 3.46Å; D326-K330 IonicContact OD1-NZ 2.68Å; D326-K330 PolarHBondContact OD1-NZ 3.43Å; D326-K330 IonicContact OD2-NZ 3.16Å; D326-K330 PolarHBondContact OD2-NZ 2.98Å; S327-K330 PolarHBondContact O-N 2.83Å; K330-K334 WeakPolarHBondContact O-CB 3.1Å; K330-K334 PolarHBondContact O-N 3.26Å
331	W	72.3	Confident	71	Confident	56 Å²	56	84.7 Å²	84.7	21%	0.212	40%	0.404	C	S	.	.	H	α-helix	trans	-71.2	-47.2	176.2	-179	89.4	0	0	0	112.2	S327 M328 T329 D333 K334 V335 Y361 W365	S327-W331 VanDerWaalsContact O-CB 3.23Å; S327-W331 WeakPolarHBondContact O-CB 3.35Å; S327-W331 PolarHBondContact O-N 2.92Å; M328-W331 CarbonylContact O-C 3.6Å; M328-W331 PolarHBondContact O-N 3.15Å; T329-W331 VanDerWaalsContact C-N 3.3Å; T329-W331 PolarHBondContact O-N 3.4Å; W331-D333 VanDerWaalsContact C-N 3.26Å; W331-D333 PolarHBondContact O-N 2.99Å; W331-K334 CarbonylContact O-C 3.25Å; W331-K334 WeakPolarHBondContact O-CA 3.44Å; W331-K334 VanDerWaalsContact O-CB 3.28Å; W331-K334 WeakPolarHBondContact O-CB 3.44Å; W331-K334 PolarHBondContact O-N 3.03Å; W331-V335 HydrophobicContact CD2-CG2 4.04Å; W331-V335 HydrophobicContact CE3-CG2 4.24Å; W331-V335 HydrophobicContact CH2-CB 4.42Å; W331-V335 HydrophobicContact CH2-CG2 3.49Å; W331-V335 VanDerWaalsContact CH2-CG2 3.49Å; W331-V335 HydrophobicContact CZ2-CG2 3.26Å; W331-V335 HydrophobicContact CZ3-CG2 4.01Å; W331-V335 WeakPolarHBondContact O-CG2 3.27Å; W331-V335 PolarHBondContact O-N 3.07Å; W331-Y361 HydrophobicContact CZ2-CD2 4.02Å; W331-Y361 AromaticContact CZ2-CG 3.91Å; W331-Y361 HydrophobicContact CZ2-CG 3.91Å; W331-W365 HydrophobicContact CZ3-CB 4.37Å
332	L	70.4	Confident	70	Confident	35 Å²	35	87.5 Å²	87.5	18%	0.183	41%	0.412	C	S	.	.	H	α-helix	trans	-59.3	-37.8	173.9	-75.1	169.5	0	0	0	110.8	M328 T329 V335 K336	M328-L332 HydrophobicContact CE-CD1 4.45Å; M328-L332 WeakPolarHBondContact O-CB 3.08Å; M328-L332 WeakPolarHBondContact O-CG 3.36Å; M328-L332 PolarHBondContact O-N 3.01Å; T329-L332 PolarHBondContact O-N 3.16Å; L332-V335 CarbonylContact O-C 3.43Å; L332-V335 PolarHBondContact O-N 3.41Å; L332-K336 WeakPolarHBondContact O-CB 3.45Å; L332-K336 VanDerWaalsContact O-CG 3.24Å; L332-K336 WeakPolarHBondContact O-CG 3.4Å; L332-K336 PolarHBondContact O-N 2.87Å
333	D	74.3	Confident	68.9	Low	73 Å²	73	89.3 Å²	89.3	39%	0.39	42%	0.418	S	S	.	.	H	α-helix	trans	-71.1	-29.8	173.2	-105.7	10.9	0	0	0	113.7	T329 W331 R337	T329-D333 WeakPolarHBondContact O-CB 3.46Å; T329-D333 PolarHBondContact O-N 3.33Å; W331-D333 VanDerWaalsContact C-N 3.26Å; W331-D333 PolarHBondContact O-N 2.99Å; D333-R337 WeakPolarHBondContact O-CB 3.16Å; D333-R337 WeakPolarHBondContact O-CG 3.25Å; D333-R337 PolarHBondContact O-N 2.72Å; D333-R337 PolarHBondContact O-NE 3.22Å
334	K	75.1	Confident	67.9	Low	131 Å²	131	87 Å²	87	57%	0.57	44%	0.435	S	S	*	.	H	α-helix	trans	-68.6	-39.9	169.8	-167	177.4	-177.9	179.1	0	110.1	K330 W331 R337 I338	K330-K334 WeakPolarHBondContact O-CB 3.1Å; K330-K334 PolarHBondContact O-N 3.26Å; W331-K334 CarbonylContact O-C 3.25Å; W331-K334 WeakPolarHBondContact O-CA 3.44Å; W331-K334 VanDerWaalsContact O-CB 3.28Å; W331-K334 WeakPolarHBondContact O-CB 3.44Å; W331-K334 PolarHBondContact O-N 3.03Å; K334-R337 PolarHBondContact O-N 2.95Å; K334-I338 HydrophobicContact CG-CD1 4.27Å; K334-I338 WeakPolarHBondContact O-CD1 3.36Å; K334-I338 VanDerWaalsContact O-CG1 3.24Å; K334-I338 WeakPolarHBondContact O-CG1 3.39Å; K334-I338 PolarHBondContact O-N 3.46Å
335	V	67	Low	66.5	Low	5 Å²	5	91.3 Å²	91.3	3%	0.03	45%	0.454	C	S	.	.	H	α-helix	trans	-71	-41.5	174.4	175.7	0	0	0	0	112.4	W331 L332 R337 I338 K339	W331-V335 HydrophobicContact CD2-CG2 4.04Å; W331-V335 HydrophobicContact CE3-CG2 4.24Å; W331-V335 HydrophobicContact CH2-CB 4.42Å; W331-V335 HydrophobicContact CH2-CG2 3.49Å; W331-V335 VanDerWaalsContact CH2-CG2 3.49Å; W331-V335 HydrophobicContact CZ2-CG2 3.26Å; W331-V335 HydrophobicContact CZ3-CG2 4.01Å; W331-V335 WeakPolarHBondContact O-CG2 3.27Å; W331-V335 PolarHBondContact O-N 3.07Å; L332-V335 CarbonylContact O-C 3.43Å; L332-V335 PolarHBondContact O-N 3.41Å; V335-R337 VanDerWaalsContact C-N 3.28Å; V335-R337 PolarHBondContact O-N 3.02Å; V335-I338 CarbonylContact O-C 3.57Å; V335-I338 PolarHBondContact O-N 3.47Å; V335-I338 VanDerWaalsContact O-N 3.11Å; V335-K339 HydrophobicContact CG1-CD 4.04Å; V335-K339 HydrophobicContact CG1-CG 4.28Å; V335-K339 WeakPolarHBondContact O-CB 3.38Å; V335-K339 WeakPolarHBondContact O-CG 3.4Å; V335-K339 PolarHBondContact O-N 3.49Å
336	K	73.3	Confident	65.3	Low	98 Å²	98	93.6 Å²	93.6	43%	0.426	46%	0.464	S	S	.	.	H	α-helix	trans	-60.2	-38.8	172.6	-73.9	167.2	-178.5	174.6	0	110.3	L332 K339 R340	L332-K336 WeakPolarHBondContact O-CB 3.45Å; L332-K336 VanDerWaalsContact O-CG 3.24Å; L332-K336 WeakPolarHBondContact O-CG 3.4Å; L332-K336 PolarHBondContact O-N 2.87Å; K336-K339 PolarHBondContact O-N 3.2Å; K336-R340 VanDerWaalsContact O-CB 3.3Å; K336-R340 WeakPolarHBondContact O-CB 3.42Å; K336-R340 VanDerWaalsContact O-CG 3.31Å; K336-R340 WeakPolarHBondContact O-CG 3.34Å; K336-R340 PolarHBondContact O-N 3.37Å
337	R	71.4	Confident	64.1	Low	156 Å²	156	95.5 Å²	95.5	59%	0.589	47%	0.472	S	S	*	.	H	α-helix	trans	-65.7	-41.5	169.5	-80.5	177	-81.5	-170.9	-9.3	113.5	D333 K334 V335 R340 S341	D333-R337 WeakPolarHBondContact O-CB 3.16Å; D333-R337 WeakPolarHBondContact O-CG 3.25Å; D333-R337 PolarHBondContact O-N 2.72Å; D333-R337 PolarHBondContact O-NE 3.22Å; K334-R337 PolarHBondContact O-N 2.95Å; V335-R337 VanDerWaalsContact C-N 3.28Å; V335-R337 PolarHBondContact O-N 3.02Å; R337-R340 PolarHBondContact O-N 2.95Å; R337-S341 WeakPolarHBondContact O-CB 3.34Å; R337-S341 PolarHBondContact O-N 3.49Å; R337-S341 PolarHBondContact O-OG 2.86Å
338	I	63.4	Low	63	Low	59 Å²	59	98 Å²	98	30%	0.303	49%	0.487	S	S	.	.	H	α-helix	trans	-68.2	-32.6	175.9	-70.1	162.9	0	0	0	111.7	K334 V335 S341 Y342	K334-I338 HydrophobicContact CG-CD1 4.27Å; K334-I338 WeakPolarHBondContact O-CD1 3.36Å; K334-I338 VanDerWaalsContact O-CG1 3.24Å; K334-I338 WeakPolarHBondContact O-CG1 3.39Å; K334-I338 PolarHBondContact O-N 3.46Å; V335-I338 CarbonylContact O-C 3.57Å; V335-I338 PolarHBondContact O-N 3.47Å; V335-I338 VanDerWaalsContact O-N 3.11Å; I338-S341 WeakPolarHBondContact CA-OG 3.4Å; I338-S341 PolarHBondContact O-OG 2.97Å; I338-Y342 VanDerWaalsContact O-CD2 3.29Å; I338-Y342 WeakPolarHBondContact O-CD2 3.48Å
339	K	66.3	Low	62.2	Low	120 Å²	120	97.8 Å²	97.8	52%	0.522	49%	0.487	S	S	.	.	H	α-helix	trans	-72.3	-48.2	172.8	-70.4	176.3	-176.3	173.3	0	110.8	V335 K336 S341 Y342 N362	V335-K339 HydrophobicContact CG1-CD 4.04Å; V335-K339 HydrophobicContact CG1-CG 4.28Å; V335-K339 WeakPolarHBondContact O-CB 3.38Å; V335-K339 WeakPolarHBondContact O-CG 3.4Å; V335-K339 PolarHBondContact O-N 3.49Å; K336-K339 PolarHBondContact O-N 3.2Å; K339-S341 VanDerWaalsContact C-N 3.34Å; K339-S341 PolarHBondContact O-N 2.96Å; K339-Y342 CarbonylContact O-C 3.53Å; K339-Y342 PolarHBondContact O-N 2.94Å; K339-Y342 VanDerWaalsContact O-N 3.13Å; K339-N362 PolarHBondContact NZ-OD1 2.88Å
340	R	70.4	Confident	61.5	Low	193 Å²	193	103.8 Å²	103.8	73%	0.728	51%	0.507	S	S	*	.	H	α-helix	trans	-62.5	-32.6	177.4	-77.3	177.1	174.9	146.3	-2.5	114.3	K336 R337 Y342 P343	K336-R340 VanDerWaalsContact O-CB 3.3Å; K336-R340 WeakPolarHBondContact O-CB 3.42Å; K336-R340 VanDerWaalsContact O-CG 3.31Å; K336-R340 WeakPolarHBondContact O-CG 3.34Å; K336-R340 PolarHBondContact O-N 3.37Å; R337-R340 PolarHBondContact O-N 2.95Å; R340-Y342 VanDerWaalsContact C-N 3.26Å; R340-Y342 PolarHBondContact O-N 3.39Å; R340-P343 WeakPolarHBondContact O-CD 3.18Å
341	S	64.2	Low	60.5	Low	78 Å²	78	106.1 Å²	106.1	55%	0.545	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-0.9	176.3	51.3	0	0	0	0	114.5	R337 I338 K339 P343	R337-S341 WeakPolarHBondContact O-CB 3.34Å; R337-S341 PolarHBondContact O-N 3.49Å; R337-S341 PolarHBondContact O-OG 2.86Å; I338-S341 WeakPolarHBondContact CA-OG 3.4Å; I338-S341 PolarHBondContact O-OG 2.97Å; K339-S341 VanDerWaalsContact C-N 3.34Å; K339-S341 PolarHBondContact O-N 2.96Å; S341-P343 VanDerWaalsContact C-CD 3.47Å
342	Y	50.3	Low	59.7	Low	114 Å²	114	107.4 Å²	107.4	45%	0.447	53%	0.528	S	S	.	.	S	Bend	trans	-130.5	62.2	171.9	-71.3	-103.6	0	0	0	110.4	I338 K339 R340	I338-Y342 VanDerWaalsContact O-CD2 3.29Å; I338-Y342 WeakPolarHBondContact O-CD2 3.48Å; K339-Y342 CarbonylContact O-C 3.53Å; K339-Y342 PolarHBondContact O-N 2.94Å; K339-Y342 VanDerWaalsContact O-N 3.13Å; R340-Y342 VanDerWaalsContact C-N 3.26Å; R340-Y342 PolarHBondContact O-N 3.39Å
343	P	45.9	Very low	59.5	Low	98 Å²	98	113.2 Å²	113.2	64%	0.636	55%	0.552	S	S	*	*			trans	-73.3	134	-176.2	32.1	-34.5	0	0	0	111.7	R340 S341 E345	R340-P343 WeakPolarHBondContact O-CD 3.18Å; S341-P343 VanDerWaalsContact C-CD 3.47Å; P343-E345 PolarHBondContact O-N 3.23Å
344	G	53.4	Low	58.7	Low	84 Å²	84	113.4 Å²	113.4	87%	0.866	55%	0.552	S	S	*	*	S	Bend	trans	67.5	-49.7	162.2	0	0	0	0	0	118.2	K346	G344-K346 PolarHBondContact O-N 2.88Å
345	E	45.9	Very low	57.8	Low	126 Å²	126	112.8 Å²	112.8	59%	0.589	55%	0.546	S	S	*	.			trans	-70.7	127.6	-163.4	-153.9	-178.7	-157.4	0	0	112.3	P343 M347	P343-E345 PolarHBondContact O-N 3.23Å; E345-M347 HydrophobicContact CB-CG 4.36Å; E345-M347 VanDerWaalsContact CD-CG 3.43Å; E345-M347 HydrophobicContact CG-CG 3.82Å; E345-M347 PolarHBondContact O-N 3.44Å; E345-M347 WeakPolarHBondContact OE1-CE 3.33Å; E345-M347 WeakPolarHBondContact OE2-CG 3.39Å
346	K	48.1	Very low	57.6	Low	197 Å²	197	120.6 Å²	120.6	86%	0.857	58%	0.58	S	S	*	*			trans	-73.2	23.5	176.4	-66.7	179.2	-178.8	171.6	0	113.1	G344	G344-K346 PolarHBondContact O-N 2.88Å
347	M	46.8	Very low	56.8	Low	108 Å²	108	123.7 Å²	123.7	53%	0.532	59%	0.589	S	S	.	*			trans	-53.1	134.3	167.5	-79	-71.9	176	0	0	109.8	E345 S349	E345-M347 HydrophobicContact CB-CG 4.36Å; E345-M347 VanDerWaalsContact CD-CG 3.43Å; E345-M347 HydrophobicContact CG-CG 3.82Å; E345-M347 PolarHBondContact O-N 3.44Å; E345-M347 WeakPolarHBondContact OE1-CE 3.33Å; E345-M347 WeakPolarHBondContact OE2-CG 3.39Å; M347-S349 VanDerWaalsContact C-N 3.34Å; M347-S349 PolarHBondContact O-N 3.39Å
348	P	49	Very low	56.1	Low	108 Å²	108	116.9 Å²	116.9	70%	0.701	57%	0.566	S	S	*	*			trans	-64.4	99.4	169	27.6	-32.3	0	0	0	107.5	K350	P348-K350 PolarHBondContact O-N 3Å; P348-K350 VanDerWaalsContact O-N 3.15Å
349	S	50.6	Low	55.7	Low	15 Å²	15	116.9 Å²	116.9	11%	0.105	58%	0.575	C	S	.	*			trans	-49.9	124.4	-173.7	59.4	0	0	0	0	109.5	M347 R351 P352	M347-S349 VanDerWaalsContact C-N 3.34Å; M347-S349 PolarHBondContact O-N 3.39Å; S349-R351 CarbonylContact O-C 3.57Å; S349-R351 PolarHBondContact O-N 2.85Å; S349-P352 VanDerWaalsContact O-CD 3.23Å; S349-P352 WeakPolarHBondContact O-CD 3.49Å
350	K	56.4	Low	55.2	Low	202 Å²	202	114 Å²	114	88%	0.878	57%	0.57	S	S	*	*	S	Bend	trans	-55.8	-7.3	-170.7	-66.2	-176.9	178.3	179	0	115.3	P348	P348-K350 PolarHBondContact O-N 3Å; P348-K350 VanDerWaalsContact O-N 3.15Å
351	R	55.3	Low	54.2	Low	172 Å²	172	109.8 Å²	109.8	65%	0.649	56%	0.555	S	S	*	*			trans	-132.3	76.5	169.9	-56.4	-176.9	178.8	177.4	-4.9	109.5	S349 K353 L354 R355	S349-R351 CarbonylContact O-C 3.57Å; S349-R351 PolarHBondContact O-N 2.85Å; R351-K353 VanDerWaalsContact C-N 3.26Å; R351-K353 PolarHBondContact O-N 3.36Å; R351-L354 HydrophobicContact CB-CB 3.85Å; R351-L354 HydrophobicContact CB-CD1 4.1Å; R351-L354 WeakPolarHBondContact O-CA 3.49Å; R351-L354 VanDerWaalsContact O-CB 3.3Å; R351-L354 WeakPolarHBondContact O-CB 3.37Å; R351-L354 PolarHBondContact O-N 3.18Å; R351-R355 PolarHBondContact O-N 2.85Å
352	P	56.1	Low	53.6	Low	84 Å²	84	107.6 Å²	107.6	55%	0.545	54%	0.537	S	S	.	.	H	α-helix	trans	-66.4	-30.4	-177.6	28.3	-33.7	0	0	0	111.7	S349 L354 R355 K356	S349-P352 VanDerWaalsContact O-CD 3.23Å; S349-P352 WeakPolarHBondContact O-CD 3.49Å; P352-L354 PolarHBondContact O-N 3.05Å; P352-R355 PolarHBondContact O-N 3.23Å; P352-K356 PolarHBondContact O-N 3.24Å
353	K	67	Low	53.6	Low	156 Å²	156	108.3 Å²	108.3	68%	0.678	54%	0.54	S	S	*	.	H	α-helix	trans	-54.1	-30.9	167.9	-66.6	-170.1	177.3	-173	0	112.1	R351 R357	R351-K353 VanDerWaalsContact C-N 3.26Å; R351-K353 PolarHBondContact O-N 3.36Å; K353-R357 WeakPolarHBondContact O-CB 3.44Å; K353-R357 VanDerWaalsContact O-CG 3.29Å; K353-R357 WeakPolarHBondContact O-CG 3.32Å; K353-R357 PolarHBondContact O-N 3.38Å
354	L	56.5	Low	53.9	Low	77 Å²	77	105.9 Å²	105.9	40%	0.403	52%	0.521	S	S	.	.	H	α-helix	trans	-82.3	-35	178.5	-117.1	159.1	0	0	0	113.2	R351 P352 A358	R351-L354 HydrophobicContact CB-CB 3.85Å; R351-L354 HydrophobicContact CB-CD1 4.1Å; R351-L354 WeakPolarHBondContact O-CA 3.49Å; R351-L354 VanDerWaalsContact O-CB 3.3Å; R351-L354 WeakPolarHBondContact O-CB 3.37Å; R351-L354 PolarHBondContact O-N 3.18Å; P352-L354 PolarHBondContact O-N 3.05Å; L354-A358 WeakPolarHBondContact O-CB 3.37Å; L354-A358 PolarHBondContact O-N 3.34Å
355	R	57.1	Low	53.5	Low	118 Å²	118	104.4 Å²	104.4	45%	0.445	49%	0.489	S	S	.	.	H	α-helix	trans	-66.5	-41	167.5	-91.1	-169.1	174.9	168.9	-3	111.2	R351 P352 A358 A359	R351-R355 PolarHBondContact O-N 2.85Å; P352-R355 PolarHBondContact O-N 3.23Å; R355-A358 PolarHBondContact O-N 3.38Å; R355-A359 WeakPolarHBondContact O-CB 3.16Å; R355-A359 PolarHBondContact O-N 2.99Å
356	K	61.7	Low	53.5	Low	169 Å²	169	100.9 Å²	100.9	74%	0.735	48%	0.475	S	S	*	.	H	α-helix	trans	-60.8	-50.6	172.6	-80	-163.9	172.8	-168.2	0	112.1	P352 A358 A359 S360	P352-K356 PolarHBondContact O-N 3.24Å; K356-A358 PolarHBondContact O-N 3.27Å; K356-A359 WeakPolarHBondContact O-CB 3.28Å; K356-A359 PolarHBondContact O-N 2.73Å; K356-A359 VanDerWaalsContact O-N 3.11Å; K356-S360 PolarHBondContact O-N 3.49Å; K356-S360 PolarHBondContact O-OG 2.94Å
357	R	57.2	Low	53.5	Low	163 Å²	163	94 Å²	94	62%	0.615	45%	0.449	S	S	*	.	H	α-helix	trans	-58.8	-44.1	174.7	-77.4	178.1	-179.6	-176	0.5	112.2	K353 A359 S360 Y361	K353-R357 WeakPolarHBondContact O-CB 3.44Å; K353-R357 VanDerWaalsContact O-CG 3.29Å; K353-R357 WeakPolarHBondContact O-CG 3.32Å; K353-R357 PolarHBondContact O-N 3.38Å; R357-A359 VanDerWaalsContact C-N 3.27Å; R357-A359 PolarHBondContact O-N 2.91Å; R357-S360 WeakPolarHBondContact CA-OG 3.34Å; R357-S360 PolarHBondContact O-N 3Å; R357-S360 PolarHBondContact O-OG 3.37Å; R357-S360 VanDerWaalsContact O-OG 3.07Å; R357-Y361 HydrophobicContact CB-CD2 4.41Å; R357-Y361 HydrophobicContact CB-CE2 4.28Å; R357-Y361 WeakPolarHBondContact O-CB 3.03Å; R357-Y361 WeakPolarHBondContact O-CD2 3.21Å; R357-Y361 PolarHBondContact O-N 3.01Å
358	A	56	Low	53.4	Low	14 Å²	14	94.1 Å²	94.1	12%	0.116	45%	0.448	C	S	.	.	H	α-helix	trans	-63.4	-33	176.4	0	0	0	0	0	112.4	L354 R355 K356 N362	L354-A358 WeakPolarHBondContact O-CB 3.37Å; L354-A358 PolarHBondContact O-N 3.34Å; R355-A358 PolarHBondContact O-N 3.38Å; K356-A358 PolarHBondContact O-N 3.27Å; A358-N362 VanDerWaalsContact O-CB 3.28Å; A358-N362 WeakPolarHBondContact O-CB 3.28Å; A358-N362 PolarHBondContact O-N 2.91Å
359	A	54.9	Low	53.6	Low	59 Å²	59	94.7 Å²	94.7	49%	0.488	44%	0.442	S	S	.	.	H	α-helix	trans	-74.6	-42.9	175	0	0	0	0	0	113	R355 K356 R357 Y361 N362 Y363	R355-A359 WeakPolarHBondContact O-CB 3.16Å; R355-A359 PolarHBondContact O-N 2.99Å; K356-A359 WeakPolarHBondContact O-CB 3.28Å; K356-A359 PolarHBondContact O-N 2.73Å; K356-A359 VanDerWaalsContact O-N 3.11Å; R357-A359 VanDerWaalsContact C-N 3.27Å; R357-A359 PolarHBondContact O-N 2.91Å; A359-Y361 VanDerWaalsContact C-N 3.33Å; A359-Y361 PolarHBondContact O-N 2.86Å; A359-N362 CarbonylContact O-C 3.4Å; A359-N362 PolarHBondContact O-N 3.05Å; A359-N362 VanDerWaalsContact O-N 3.13Å; A359-Y363 PolarHBondContact O-N 2.88Å
360	S	55.8	Low	53.4	Low	59 Å²	59	97 Å²	97	41%	0.413	45%	0.451	S	S	.	.	H	α-helix	trans	-66	-36.4	176.3	63.2	0	0	0	0	111.9	K356 R357 Y363 I364	K356-S360 PolarHBondContact O-N 3.49Å; K356-S360 PolarHBondContact O-OG 2.94Å; R357-S360 WeakPolarHBondContact CA-OG 3.34Å; R357-S360 PolarHBondContact O-N 3Å; R357-S360 PolarHBondContact O-OG 3.37Å; R357-S360 VanDerWaalsContact O-OG 3.07Å; S360-Y363 WeakPolarHBondContact O-CB 3.36Å; S360-Y363 PolarHBondContact O-N 3.24Å; S360-I364 WeakPolarHBondContact O-CD1 3.29Å; S360-I364 VanDerWaalsContact O-CG1 3.29Å; S360-I364 WeakPolarHBondContact O-CG1 3.46Å; S360-I364 PolarHBondContact O-N 2.96Å
361	Y	50.2	Low	52.9	Low	105 Å²	105	90 Å²	90	41%	0.412	43%	0.427	S	S	.	.	H	α-helix	trans	-72.3	-33.3	169.5	-68.4	-50.1	0	0	0	112.6	W331 R357 A359 Y363 I364 W365	W331-Y361 HydrophobicContact CZ2-CD2 4.02Å; W331-Y361 AromaticContact CZ2-CG 3.91Å; W331-Y361 HydrophobicContact CZ2-CG 3.91Å; R357-Y361 HydrophobicContact CB-CD2 4.41Å; R357-Y361 HydrophobicContact CB-CE2 4.28Å; R357-Y361 WeakPolarHBondContact O-CB 3.03Å; R357-Y361 WeakPolarHBondContact O-CD2 3.21Å; R357-Y361 PolarHBondContact O-N 3.01Å; A359-Y361 VanDerWaalsContact C-N 3.33Å; A359-Y361 PolarHBondContact O-N 2.86Å; Y361-Y363 PolarHBondContact O-N 2.73Å; Y361-I364 HydrophobicContact CD1-CD1 4.18Å; Y361-I364 PolarHBondContact O-N 3.1Å; Y361-W365 AromaticContact CD1-NE1 3.86Å; Y361-W365 WeakPolarHBondContact O-CB 3.39Å; Y361-W365 VanDerWaalsContact O-CD1 3.26Å; Y361-W365 PolarHBondContact O-N 2.88Å
362	N	52.2	Low	52.6	Low	32 Å²	32	86.5 Å²	86.5	17%	0.171	42%	0.421	C	S	.	.	H	α-helix	trans	-66.8	-23.4	170.9	-115.9	122	0	0	0	112.6	K339 A358 A359 N366	K339-N362 PolarHBondContact NZ-OD1 2.88Å; A358-N362 VanDerWaalsContact O-CB 3.28Å; A358-N362 WeakPolarHBondContact O-CB 3.28Å; A358-N362 PolarHBondContact O-N 2.91Å; A359-N362 CarbonylContact O-C 3.4Å; A359-N362 PolarHBondContact O-N 3.05Å; A359-N362 VanDerWaalsContact O-N 3.13Å; N362-N366 PolarHBondContact ND2-OD1 2.98Å; N362-N366 WeakPolarHBondContact O-CB 3.28Å; N362-N366 VanDerWaalsContact O-CG 3.22Å; N362-N366 PolarHBondContact O-N 3.47Å; N362-N366 PolarHBondContact O-OD1 2.79Å
363	Y	49.6	Very low	52.2	Low	129 Å²	129	90.9 Å²	90.9	51%	0.506	44%	0.44	S	S	.	.	H	α-helix	trans	-71.9	-66.6	168.9	-173.8	-99.8	0	0	0	108.3	A359 S360 Y361 W365 N366 R374 G375	A359-Y363 PolarHBondContact O-N 2.88Å; S360-Y363 WeakPolarHBondContact O-CB 3.36Å; S360-Y363 PolarHBondContact O-N 3.24Å; Y361-Y363 PolarHBondContact O-N 2.73Å; Y363-W365 VanDerWaalsContact C-N 3.27Å; Y363-W365 PolarHBondContact O-N 2.86Å; Y363-N366 PolarHBondContact O-N 3.08Å; Y363-R374 CarbonylContact C-O 3.48Å; Y363-R374 WeakPolarHBondContact CD1-O 3.29Å; Y363-R374 HydrophobicContact CD2-CB 3.84Å; Y363-R374 HydrophobicContact CD2-CG 4.4Å; Y363-R374 WeakPolarHBondContact CD2-O 2.98Å; Y363-R374 WeakPolarHBondContact CE1-O 3.48Å; Y363-R374 HydrophobicContact CE2-CB 3.57Å; Y363-R374 HydrophobicContact CE2-CG 3.79Å; Y363-R374 VanDerWaalsContact O-O 3.05Å; Y363-G375 VanDerWaalsContact O-CA 3.32Å; Y363-G375 WeakPolarHBondContact O-CA 3.21Å
364	I	51.9	Low	51.6	Low	47 Å²	47	89.6 Å²	89.6	24%	0.241	43%	0.431	C	S	.	.	H	α-helix	trans	-46.9	-44.4	-178.9	-65.7	160.7	0	0	0	113.6	S360 Y361 I376 I381	S360-I364 WeakPolarHBondContact O-CD1 3.29Å; S360-I364 VanDerWaalsContact O-CG1 3.29Å; S360-I364 WeakPolarHBondContact O-CG1 3.46Å; S360-I364 PolarHBondContact O-N 2.96Å; Y361-I364 HydrophobicContact CD1-CD1 4.18Å; Y361-I364 PolarHBondContact O-N 3.1Å; I364-I376 HydrophobicContact CG1-CD1 4.27Å; I364-I376 HydrophobicContact CG2-CD1 4.23Å; I364-I376 HydrophobicContact CG2-CG1 4.5Å; I364-I376 PolarHBondContact O-N 3.01Å; I364-I381 HydrophobicContact CG2-CD1 4.05Å
365	W	44.4	Very low	51.4	Low	52 Å²	52	87 Å²	87	20%	0.197	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	13.3	-169.6	-57.7	103.7	0	0	0	114.9	M328 W331 Y361 Y363 T367 M378 I381	M328-W365 HydrophobicContact CE-CB 4.22Å; M328-W365 HydrophobicContact CE-CE3 4.34Å; M328-W365 VanDerWaalsContact CE-O 3.29Å; M328-W365 WeakPolarHBondContact CE-O 3.29Å; M328-W365 HydrophobicContact CG-CD2 4.26Å; M328-W365 HydrophobicContact CG-CE3 3.61Å; M328-W365 HydrophobicContact CG-CZ3 3.93Å; M328-W365 HydrophobicContact SD-CD2 4.45Å; M328-W365 HydrophobicContact SD-CE3 3.46Å; M328-W365 HydrophobicContact SD-CZ3 3.9Å; W331-W365 HydrophobicContact CZ3-CB 4.37Å; Y361-W365 AromaticContact CD1-NE1 3.86Å; Y361-W365 WeakPolarHBondContact O-CB 3.39Å; Y361-W365 VanDerWaalsContact O-CD1 3.26Å; Y361-W365 PolarHBondContact O-N 2.88Å; Y363-W365 VanDerWaalsContact C-N 3.27Å; Y363-W365 PolarHBondContact O-N 2.86Å; W365-T367 VanDerWaalsContact C-N 3.34Å; W365-T367 PolarHBondContact O-N 2.81Å; W365-T367 VanDerWaalsContact O-N 3.09Å; W365-M378 HydrophobicContact CZ3-CE 4.5Å; W365-M378 HydrophobicContact CZ3-SD 3.99Å; W365-I381 HydrophobicContact CD2-CD1 4.22Å; W365-I381 HydrophobicContact CE3-CD1 3.68Å; W365-I381 HydrophobicContact CH2-CD1 3.86Å; W365-I381 HydrophobicContact CH2-CG2 3.79Å; W365-I381 HydrophobicContact CZ2-CD1 4.32Å; W365-I381 HydrophobicContact CZ2-CG2 4.43Å; W365-I381 HydrophobicContact CZ3-CD1 3.5Å; W365-I381 VanDerWaalsContact CZ3-CD1 3.5Å; W365-I381 HydrophobicContact CZ3-CG2 4.28Å
366	N	46.8	Very low	51.4	Low	53 Å²	53	84.1 Å²	84.1	28%	0.283	42%	0.416	S	S	.	.			trans	-77.7	87.6	166.6	-107.9	50.8	0	0	0	109	N362 Y363 G375	N362-N366 PolarHBondContact ND2-OD1 2.98Å; N362-N366 WeakPolarHBondContact O-CB 3.28Å; N362-N366 VanDerWaalsContact O-CG 3.22Å; N362-N366 PolarHBondContact O-N 3.47Å; N362-N366 PolarHBondContact O-OD1 2.79Å; Y363-N366 PolarHBondContact O-N 3.08Å; N366-G375 WeakPolarHBondContact O-CA 3.05Å
367	T	48.5	Very low	51.3	Low	51 Å²	51	79.4 Å²	79.4	31%	0.313	40%	0.403	S	S	.	.			trans	-111.7	35.6	176.4	72.3	0	0	0	0	111.8	W365 E369	W365-T367 VanDerWaalsContact C-N 3.34Å; W365-T367 PolarHBondContact O-N 2.81Å; W365-T367 VanDerWaalsContact O-N 3.09Å; T367-E369 PolarHBondContact O-N 3.4Å
368	E	44.9	Very low	51.3	Low	112 Å²	112	73 Å²	73	52%	0.523	38%	0.381	S	S	.	.			trans	-76.9	102.3	163.4	-70.5	175.1	-173	0	0	105.7	E370 S371	E368-E370 PolarHBondContact O-N 2.79Å; E368-S371 PolarHBondContact O-N 3.11Å
369	E	51.6	Low	51.6	Low	119 Å²	119	79.6 Å²	79.6	56%	0.556	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	13.5	-157.2	-63.2	-176.1	122.1	0	0	115.8	T367 S855 P856	T367-E369 PolarHBondContact O-N 3.4Å; E369-S855 WeakPolarHBondContact OE2-CB 3.3Å; E369-S855 PolarHBondContact OE2-OG 2.97Å; E369-P856 HydrophobicContact CB-CB 4.37Å
370	E	48	Very low	52.2	Low	63 Å²	63	81.1 Å²	81.1	29%	0.294	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	-18.4	179.5	-66.5	-179.9	-101.6	0	0	114.6	E368 E857 K858 G860	E368-E370 PolarHBondContact O-N 2.79Å; E370-E857 HydrophobicContact CG-CB 4.39Å; E370-K858 VanDerWaalsContact CD-CD 3.48Å; E370-K858 VanDerWaalsContact CD-N 3.31Å; E370-K858 VanDerWaalsContact CG-O 3.27Å; E370-K858 WeakPolarHBondContact CG-O 2.98Å; E370-K858 WeakPolarHBondContact OE1-CD 3.4Å; E370-K858 PolarHBondContact OE1-N 3.26Å; E370-K858 IonicContact OE1-NZ 3.91Å; E370-K858 PolarHBondContact OE1-NZ 3.41Å; E370-K858 VanDerWaalsContact OE2-C 3.23Å; E370-K858 WeakPolarHBondContact OE2-CB 2.88Å; E370-K858 WeakPolarHBondContact OE2-CD 3.39Å; E370-G860 PolarHBondContact OE2-N 2.79Å
371	S	45.7	Very low	52.8	Low	56 Å²	56	79.4 Å²	79.4	39%	0.392	39%	0.391	S	S	.	.	S	Bend	trans	-122.8	90.5	-158.8	62.5	0	0	0	0	114.8	E368	E368-S371 PolarHBondContact O-N 3.11Å
372	D	48	Very low	53.4	Low	98 Å²	98	75.3 Å²	75.3	52%	0.524	38%	0.376	S	S	.	.			trans	63.8	129.8	-177.8	-63.8	-52.9	0	0	0	115.1	R374	D372-R374 HydrophobicContact CB-CB 4.36Å; D372-R374 HydrophobicContact CB-CG 3.89Å; D372-R374 VanDerWaalsContact CG-NH2 3.25Å; D372-R374 PolarHBondContact O-N 3.05Å; D372-R374 IonicContact OD1-CZ 3.96Å; D372-R374 IonicContact OD1-NH1 2.95Å; D372-R374 IonicContact OD1-NH2 3.32Å; D372-R374 PolarHBondContact OD1-NH2 2.73Å; D372-R374 VanDerWaalsContact OD1-NH2 3.12Å; D372-R374 IonicContact OD2-CZ 3.71Å; D372-R374 IonicContact OD2-NE 2.69Å; D372-R374 IonicContact OD2-NH1 3.91Å; D372-R374 PolarHBondContact OD2-NH1 3.34Å; D372-R374 IonicContact OD2-NH2 2.74Å; D372-R374 PolarHBondContact OD2-NH2 3.26Å
373	N	48.8	Very low	54.2	Low	176 Å²	176	79.3 Å²	79.3	94%	0.941	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	71.1	169.9	-72.1	-14.7	0	0	0	111.3
374	R	53.6	Low	55.3	Low	129 Å²	129	77.3 Å²	77.3	49%	0.487	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-13.4	-174.3	-69.4	-177.1	-168.1	140.5	21.5	113.7	Y363 D372	Y363-R374 CarbonylContact C-O 3.48Å; Y363-R374 WeakPolarHBondContact CD1-O 3.29Å; Y363-R374 HydrophobicContact CD2-CB 3.84Å; Y363-R374 HydrophobicContact CD2-CG 4.4Å; Y363-R374 WeakPolarHBondContact CD2-O 2.98Å; Y363-R374 WeakPolarHBondContact CE1-O 3.48Å; Y363-R374 HydrophobicContact CE2-CB 3.57Å; Y363-R374 HydrophobicContact CE2-CG 3.79Å; Y363-R374 VanDerWaalsContact O-O 3.05Å; D372-R374 HydrophobicContact CB-CB 4.36Å; D372-R374 HydrophobicContact CB-CG 3.89Å; D372-R374 VanDerWaalsContact CG-NH2 3.25Å; D372-R374 PolarHBondContact O-N 3.05Å; D372-R374 IonicContact OD1-CZ 3.96Å; D372-R374 IonicContact OD1-NH1 2.95Å; D372-R374 IonicContact OD1-NH2 3.32Å; D372-R374 PolarHBondContact OD1-NH2 2.73Å; D372-R374 VanDerWaalsContact OD1-NH2 3.12Å; D372-R374 IonicContact OD2-CZ 3.71Å; D372-R374 IonicContact OD2-NE 2.69Å; D372-R374 IonicContact OD2-NH1 3.91Å; D372-R374 PolarHBondContact OD2-NH1 3.34Å; D372-R374 IonicContact OD2-NH2 2.74Å; D372-R374 PolarHBondContact OD2-NH2 3.26Å
375	G	53.2	Low	56	Low	24 Å²	24	83.9 Å²	83.9	25%	0.247	41%	0.411	C	S	.	.	S	Bend	trans	-79.1	147.1	166.4	0	0	0	0	0	111.9	Y363 N366	Y363-G375 VanDerWaalsContact O-CA 3.32Å; Y363-G375 WeakPolarHBondContact O-CA 3.21Å; N366-G375 WeakPolarHBondContact O-CA 3.05Å
376	I	55.9	Low	56.9	Low	56 Å²	56	87.5 Å²	87.5	29%	0.287	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-80	125.7	160.3	-58.1	-179.1	0	0	0	105.9	I364 M378 M380 I381	I364-I376 HydrophobicContact CG1-CD1 4.27Å; I364-I376 HydrophobicContact CG2-CD1 4.23Å; I364-I376 HydrophobicContact CG2-CG1 4.5Å; I364-I376 PolarHBondContact O-N 3.01Å; I376-M378 PolarHBondContact O-N 3.46Å; I376-M380 HydrophobicContact CG2-CB 3.88Å; I376-M380 HydrophobicContact CG2-SD 4.39Å; I376-I381 HydrophobicContact CB-CD1 4.21Å; I376-I381 HydrophobicContact CB-CG1 4.13Å; I376-I381 HydrophobicContact CG2-CD1 4.31Å; I376-I381 HydrophobicContact CG2-CG1 3.69Å
377	P	60.9	Low	58.2	Low	71 Å²	71	90 Å²	90	46%	0.461	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-55.6	134	177.9	-26.1	34.7	0	0	0	111.1	K379 M380 I381	P377-K379 PolarHBondContact O-N 3.38Å; P377-M380 HydrophobicContact CG-SD 4.47Å; P377-M380 WeakPolarHBondContact O-CB 3.25Å; P377-M380 PolarHBondContact O-N 2.96Å; P377-I381 PolarHBondContact O-N 2.93Å
378	M	55.7	Low	59.1	Low	29 Å²	29	96.1 Å²	96.1	14%	0.143	46%	0.455	C	S	.	.	H	α-helix	trans	-48.9	-35.3	178.6	178.3	71.2	99.2	0	0	112.4	L321 L324 M328 W365 I376 I381 I382	L321-M378 HydrophobicContact CD2-CG 3.96Å; L324-M378 HydrophobicContact CB-CE 3.54Å; L324-M378 HydrophobicContact CB-SD 3.82Å; L324-M378 HydrophobicContact CD1-SD 4.05Å; L324-M378 HydrophobicContact CG-SD 4.49Å; M328-M378 HydrophobicContact CG-CE 4.2Å; M328-M378 HydrophobicContact SD-CE 3.31Å; M328-M378 WeakPolarHBondContact SD-CE 3.33Å; M328-M378 HydrophobicContact SD-SD 4.34Å; W365-M378 HydrophobicContact CZ3-CE 4.5Å; W365-M378 HydrophobicContact CZ3-SD 3.99Å; I376-M378 PolarHBondContact O-N 3.46Å; M378-I381 PolarHBondContact O-N 3.31Å; M378-I382 HydrophobicContact CG-CD1 3.91Å; M378-I382 WeakPolarHBondContact O-CG1 3.5Å; M378-I382 PolarHBondContact O-N 3.49Å; M378-I382 HydrophobicContact SD-CD1 4.46Å
379	K	62.3	Low	59.9	Low	152 Å²	152	97.2 Å²	97.2	66%	0.661	46%	0.458	S	S	*	.	H	α-helix	trans	-56.6	-51.2	175.1	-61.6	175.8	-174.5	170.1	0	112.2	P377 I381 I382 E383	P377-K379 PolarHBondContact O-N 3.38Å; K379-I381 VanDerWaalsContact C-N 3.3Å; K379-I381 PolarHBondContact O-N 3.01Å; K379-I382 PolarHBondContact O-N 2.82Å; K379-E383 WeakPolarHBondContact O-CB 3.38Å; K379-E383 PolarHBondContact O-N 2.89Å
380	M	68.2	Low	60.7	Low	90 Å²	90	93.7 Å²	93.7	44%	0.443	45%	0.45	S	S	.	.	H	α-helix	trans	-61.9	-36.4	176.4	-75.1	-175.3	74.6	0	0	112.3	I376 P377 E383 Q384	I376-M380 HydrophobicContact CG2-CB 3.88Å; I376-M380 HydrophobicContact CG2-SD 4.39Å; P377-M380 HydrophobicContact CG-SD 4.47Å; P377-M380 WeakPolarHBondContact O-CB 3.25Å; P377-M380 PolarHBondContact O-N 2.96Å; M380-E383 PolarHBondContact O-N 3.36Å; M380-Q384 WeakPolarHBondContact O-CB 3.46Å; M380-Q384 WeakPolarHBondContact O-CG 3.41Å; M380-Q384 PolarHBondContact O-N 3.01Å
381	I	68	Low	62	Low	23 Å²	23	96.6 Å²	96.6	12%	0.118	46%	0.461	C	S	.	.	H	α-helix	trans	-66	-41.4	178.2	-55.5	177.8	0	0	0	110.4	I364 W365 I376 P377 M378 K379 W385	I364-I381 HydrophobicContact CG2-CD1 4.05Å; W365-I381 HydrophobicContact CD2-CD1 4.22Å; W365-I381 HydrophobicContact CE3-CD1 3.68Å; W365-I381 HydrophobicContact CH2-CD1 3.86Å; W365-I381 HydrophobicContact CH2-CG2 3.79Å; W365-I381 HydrophobicContact CZ2-CD1 4.32Å; W365-I381 HydrophobicContact CZ2-CG2 4.43Å; W365-I381 HydrophobicContact CZ3-CD1 3.5Å; W365-I381 VanDerWaalsContact CZ3-CD1 3.5Å; W365-I381 HydrophobicContact CZ3-CG2 4.28Å; I376-I381 HydrophobicContact CB-CD1 4.21Å; I376-I381 HydrophobicContact CB-CG1 4.13Å; I376-I381 HydrophobicContact CG2-CD1 4.31Å; I376-I381 HydrophobicContact CG2-CG1 3.69Å; P377-I381 PolarHBondContact O-N 2.93Å; M378-I381 PolarHBondContact O-N 3.31Å; K379-I381 VanDerWaalsContact C-N 3.3Å; K379-I381 PolarHBondContact O-N 3.01Å; I381-W385 WeakPolarHBondContact O-CB 3.41Å; I381-W385 PolarHBondContact O-N 2.9Å
382	I	64	Low	62.7	Low	20 Å²	20	95.3 Å²	95.3	10%	0.103	46%	0.457	C	S	.	.	H	α-helix	trans	-64.9	-42.8	174.5	-70	164.9	0	0	0	111.2	L320 L321 L324 M378 K379 W385 R386	L320-I382 HydrophobicContact CD2-CG2 4.02Å; L321-I382 HydrophobicContact CD2-CD1 3.42Å; L321-I382 VanDerWaalsContact CD2-CD1 3.42Å; L321-I382 HydrophobicContact CG-CD1 3.92Å; L324-I382 HydrophobicContact CD1-CD1 3.75Å; L324-I382 HydrophobicContact CD1-CG1 3.38Å; M378-I382 HydrophobicContact CG-CD1 3.91Å; M378-I382 WeakPolarHBondContact O-CG1 3.5Å; M378-I382 PolarHBondContact O-N 3.49Å; M378-I382 HydrophobicContact SD-CD1 4.46Å; K379-I382 PolarHBondContact O-N 2.82Å; I382-W385 CarbonylContact O-C 3.43Å; I382-W385 WeakPolarHBondContact O-CA 3.34Å; I382-W385 WeakPolarHBondContact O-CB 3.37Å; I382-W385 PolarHBondContact O-N 2.98Å; I382-R386 PolarHBondContact O-N 3.34Å
383	E	68.4	Low	63.2	Low	115 Å²	115	94.1 Å²	94.1	54%	0.537	45%	0.451	S	S	.	.	H	α-helix	trans	-67.8	-43.8	-178.9	-172.2	160.6	-138.9	0	0	112.1	K379 M380 W385 R386 N387	K379-E383 WeakPolarHBondContact O-CB 3.38Å; K379-E383 PolarHBondContact O-N 2.89Å; M380-E383 PolarHBondContact O-N 3.36Å; E383-W385 VanDerWaalsContact C-N 3.26Å; E383-W385 PolarHBondContact O-N 2.76Å; E383-R386 PolarHBondContact O-N 3.22Å; E383-N387 WeakPolarHBondContact O-CB 3.16Å; E383-N387 VanDerWaalsContact O-CG 3.23Å; E383-N387 PolarHBondContact O-N 3.17Å; E383-N387 PolarHBondContact O-OD1 3.09Å
384	Q	72.3	Confident	63.8	Low	88 Å²	88	90.2 Å²	90.2	41%	0.411	43%	0.43	S	S	.	.	H	α-helix	trans	-61.4	-33.9	169.2	-72.4	-175	6.7	0	0	112.2	M380 R388	M380-Q384 WeakPolarHBondContact O-CB 3.46Å; M380-Q384 WeakPolarHBondContact O-CG 3.41Å; M380-Q384 PolarHBondContact O-N 3.01Å; Q384-R388 WeakPolarHBondContact O-CB 3.29Å; Q384-R388 WeakPolarHBondContact O-CD 3.5Å; Q384-R388 WeakPolarHBondContact O-CG 3.44Å; Q384-R388 PolarHBondContact O-N 3.44Å
385	W	67	Low	64.1	Low	185 Å²	185	89 Å²	89	70%	0.701	43%	0.429	S	S	*	.	H	α-helix	trans	-67.7	-44.9	173	-114.5	77.3	0	0	0	112.3	I381 I382 E383 R388 F389	I381-W385 WeakPolarHBondContact O-CB 3.41Å; I381-W385 PolarHBondContact O-N 2.9Å; I382-W385 CarbonylContact O-C 3.43Å; I382-W385 WeakPolarHBondContact O-CA 3.34Å; I382-W385 WeakPolarHBondContact O-CB 3.37Å; I382-W385 PolarHBondContact O-N 2.98Å; E383-W385 VanDerWaalsContact C-N 3.26Å; E383-W385 PolarHBondContact O-N 2.76Å; W385-R388 PolarHBondContact O-N 3.35Å; W385-F389 WeakPolarHBondContact O-CB 3.28Å; W385-F389 PolarHBondContact O-N 2.83Å
386	R	62.5	Low	64.1	Low	127 Å²	127	94 Å²	94	48%	0.479	45%	0.447	S	S	.	.	H	α-helix	trans	-59.1	-48.1	174.3	-78.1	-178.4	165.4	-160.6	-7.6	111.1	I382 E383 R388 F389 A390	I382-R386 PolarHBondContact O-N 3.34Å; E383-R386 PolarHBondContact O-N 3.22Å; R386-R388 PolarHBondContact O-N 3.01Å; R386-F389 PolarHBondContact O-N 3.47Å; R386-A390 WeakPolarHBondContact O-CB 3.43Å; R386-A390 PolarHBondContact O-N 2.82Å
387	N	74.1	Confident	64.1	Low	106 Å²	106	95 Å²	95	57%	0.567	45%	0.452	S	S	*	.	H	α-helix	trans	-65.4	-37.1	-179.6	-66.7	-5.6	0	0	0	112	E383 K391	E383-N387 WeakPolarHBondContact O-CB 3.16Å; E383-N387 VanDerWaalsContact O-CG 3.23Å; E383-N387 PolarHBondContact O-N 3.17Å; E383-N387 PolarHBondContact O-OD1 3.09Å; N387-K391 VanDerWaalsContact O-CB 3.29Å; N387-K391 WeakPolarHBondContact O-CB 3.13Å; N387-K391 PolarHBondContact O-N 3.45Å
388	R	68.2	Low	63.7	Low	179 Å²	179	93.6 Å²	93.6	68%	0.675	45%	0.449	S	S	*	.	H	α-helix	trans	-69	-40.2	172.6	-74.1	172	-171.8	-145.4	2.2	112.9	Q384 W385 R386 K391 G392	Q384-R388 WeakPolarHBondContact O-CB 3.29Å; Q384-R388 WeakPolarHBondContact O-CD 3.5Å; Q384-R388 WeakPolarHBondContact O-CG 3.44Å; Q384-R388 PolarHBondContact O-N 3.44Å; W385-R388 PolarHBondContact O-N 3.35Å; R386-R388 PolarHBondContact O-N 3.01Å; R388-K391 PolarHBondContact O-N 2.81Å; R388-G392 PolarHBondContact O-N 2.98Å
389	F	61.5	Low	63.5	Low	135 Å²	135	99.4 Å²	99.4	59%	0.592	48%	0.476	S	S	*	.	H	α-helix	trans	-67.3	-42.8	178.1	-168.8	-104	0	0	0	111.3	W385 R386 G392 L393	W385-F389 WeakPolarHBondContact O-CB 3.28Å; W385-F389 PolarHBondContact O-N 2.83Å; R386-F389 PolarHBondContact O-N 3.47Å; F389-G392 PolarHBondContact O-N 3.46Å; F389-L393 HydrophobicContact CD1-CD1 3.89Å; F389-L393 HydrophobicContact CD1-CG 4.5Å; F389-L393 HydrophobicContact CE1-CD1 3.64Å; F389-L393 HydrophobicContact CE1-CG 4.3Å; F389-L393 HydrophobicContact CZ-CD1 4.34Å; F389-L393 WeakPolarHBondContact O-CG 3.43Å; F389-L393 PolarHBondContact O-N 2.95Å
390	A	69.2	Low	62.9	Low	46 Å²	46	98.7 Å²	98.7	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-42.5	171.8	0	0	0	0	0	112.2	R386 L393 N394	R386-A390 WeakPolarHBondContact O-CB 3.43Å; R386-A390 PolarHBondContact O-N 2.82Å; A390-L393 PolarHBondContact O-N 2.83Å; A390-N394 WeakPolarHBondContact O-CB 3.49Å; A390-N394 PolarHBondContact O-N 2.89Å; A390-N394 PolarHBondContact O-ND2 2.87Å
391	K	73.6	Confident	61.9	Low	123 Å²	123	101.1 Å²	101.1	54%	0.535	49%	0.486	S	S	.	.	H	α-helix	trans	-64.4	-43	175.8	-168	170.7	-170.7	-74.7	0	112.2	N387 R388 N394 E395	N387-K391 VanDerWaalsContact O-CB 3.29Å; N387-K391 WeakPolarHBondContact O-CB 3.13Å; N387-K391 PolarHBondContact O-N 3.45Å; R388-K391 PolarHBondContact O-N 2.81Å; K391-N394 PolarHBondContact O-N 3.11Å; K391-E395 IonicContact NZ-OE1 2.7Å; K391-E395 PolarHBondContact NZ-OE1 3.02Å; K391-E395 WeakPolarHBondContact O-CG 3.48Å; K391-E395 PolarHBondContact O-N 3.48Å
392	G	60.6	Low	60.6	Low	30 Å²	30	103.8 Å²	103.8	31%	0.309	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-43.6	176.1	0	0	0	0	0	112.9	R388 F389 N394 E395 E396	R388-G392 PolarHBondContact O-N 2.98Å; F389-G392 PolarHBondContact O-N 3.46Å; G392-N394 VanDerWaalsContact C-N 3.35Å; G392-N394 PolarHBondContact O-N 3.45Å; G392-E395 PolarHBondContact O-N 3.13Å; G392-E396 WeakPolarHBondContact O-CB 3.4Å; G392-E396 PolarHBondContact O-N 3.49Å
393	L	58.7	Low	59.5	Low	73 Å²	73	108.4 Å²	108.4	38%	0.382	54%	0.541	S	S	.	.	H	α-helix	trans	-60.9	-42.5	172	-72.6	173.2	0	0	0	111.9	F389 A390 E395 I397	F389-L393 HydrophobicContact CD1-CD1 3.89Å; F389-L393 HydrophobicContact CD1-CG 4.5Å; F389-L393 HydrophobicContact CE1-CD1 3.64Å; F389-L393 HydrophobicContact CE1-CG 4.3Å; F389-L393 HydrophobicContact CZ-CD1 4.34Å; F389-L393 WeakPolarHBondContact O-CG 3.43Å; F389-L393 PolarHBondContact O-N 2.95Å; A390-L393 PolarHBondContact O-N 2.83Å; L393-E395 VanDerWaalsContact C-N 3.3Å; L393-E395 PolarHBondContact O-N 3.38Å; L393-I397 VanDerWaalsContact O-CB 3.25Å; L393-I397 WeakPolarHBondContact O-CB 3.47Å; L393-I397 WeakPolarHBondContact O-CD1 3.24Å; L393-I397 WeakPolarHBondContact O-CG1 3.36Å; L393-I397 PolarHBondContact O-N 2.94Å
394	N	61.4	Low	58.3	Low	94 Å²	94	111.9 Å²	111.9	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-66.1	-31.2	177.4	-70	-22.3	0	0	0	112.8	A390 K391 G392 G398	A390-N394 WeakPolarHBondContact O-CB 3.49Å; A390-N394 PolarHBondContact O-N 2.89Å; A390-N394 PolarHBondContact O-ND2 2.87Å; K391-N394 PolarHBondContact O-N 3.11Å; G392-N394 VanDerWaalsContact C-N 3.35Å; G392-N394 PolarHBondContact O-N 3.45Å; N394-G398 WeakPolarHBondContact O-CA 3.49Å; N394-G398 PolarHBondContact O-N 3.45Å
395	E	60.9	Low	56.6	Low	102 Å²	102	119.3 Å²	119.3	48%	0.477	57%	0.573	S	S	.	*	H	α-helix	trans	-75.5	-47.6	176	-75	169.6	167.3	0	0	111.5	K391 G392 L393 I397 G398 E399	K391-E395 IonicContact NZ-OE1 2.7Å; K391-E395 PolarHBondContact NZ-OE1 3.02Å; K391-E395 WeakPolarHBondContact O-CG 3.48Å; K391-E395 PolarHBondContact O-N 3.48Å; G392-E395 PolarHBondContact O-N 3.13Å; L393-E395 VanDerWaalsContact C-N 3.3Å; L393-E395 PolarHBondContact O-N 3.38Å; E395-I397 PolarHBondContact O-N 2.75Å; E395-G398 WeakPolarHBondContact O-CA 3.43Å; E395-G398 PolarHBondContact O-N 3.42Å; E395-E399 PolarHBondContact O-N 2.92Å
396	E	52.8	Low	55.3	Low	131 Å²	131	116.5 Å²	116.5	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-63.2	-39.5	177.2	-170.2	172.1	-160.5	0	0	111.9	G392 G398 I400	G392-E396 WeakPolarHBondContact O-CB 3.4Å; G392-E396 PolarHBondContact O-N 3.49Å; E396-G398 VanDerWaalsContact C-N 3.33Å; E396-I400 WeakPolarHBondContact O-CD1 3.44Å; E396-I400 WeakPolarHBondContact O-CG1 3.41Å; E396-I400 PolarHBondContact O-N 2.91Å
397	I	54.9	Low	54.7	Low	77 Å²	77	116.1 Å²	116.1	40%	0.395	58%	0.582	S	S	.	*	H	α-helix	trans	-71.4	-30	172	-64.8	166.9	0	0	0	111.4	L393 E395 I400 K401	L393-I397 VanDerWaalsContact O-CB 3.25Å; L393-I397 WeakPolarHBondContact O-CB 3.47Å; L393-I397 WeakPolarHBondContact O-CD1 3.24Å; L393-I397 WeakPolarHBondContact O-CG1 3.36Å; L393-I397 PolarHBondContact O-N 2.94Å; E395-I397 PolarHBondContact O-N 2.75Å; I397-I400 PolarHBondContact O-N 3.41Å; I397-K401 PolarHBondContact O-N 3.4Å
398	G	53.5	Low	53.3	Low	40 Å²	40	123.7 Å²	123.7	41%	0.412	60%	0.603	S	S	.	*	H	α-helix	trans	-65.1	-44.5	175.9	0	0	0	0	0	112.7	N394 E395 E396 I400 K401 S402	N394-G398 WeakPolarHBondContact O-CA 3.49Å; N394-G398 PolarHBondContact O-N 3.45Å; E395-G398 WeakPolarHBondContact O-CA 3.43Å; E395-G398 PolarHBondContact O-N 3.42Å; E396-G398 VanDerWaalsContact C-N 3.33Å; G398-I400 VanDerWaalsContact C-N 3.34Å; G398-I400 PolarHBondContact O-N 2.68Å; G398-K401 PolarHBondContact O-N 3.42Å; G398-S402 PolarHBondContact O-N 3.08Å
399	E	50.5	Low	51.6	Low	152 Å²	152	118 Å²	118	71%	0.71	60%	0.6	S	S	*	*	H	α-helix	trans	-59.4	-44.5	174.7	-70.4	-168.9	173.8	0	0	111.5	E395 K401 S402	E395-E399 PolarHBondContact O-N 2.92Å; E399-K401 VanDerWaalsContact C-N 3.25Å; E399-K401 PolarHBondContact O-N 3.11Å; E399-S402 WeakPolarHBondContact O-CB 3.41Å; E399-S402 PolarHBondContact O-N 2.95Å; E399-S402 PolarHBondContact O-OG 2.91Å
400	I	50	Low	50.5	Low	137 Å²	137	122.4 Å²	122.4	70%	0.703	61%	0.613	S	S	*	*	H	α-helix	trans	-60.4	-32.2	178.9	-65.6	167.1	0	0	0	112.5	E396 I397 G398	E396-I400 WeakPolarHBondContact O-CD1 3.44Å; E396-I400 WeakPolarHBondContact O-CG1 3.41Å; E396-I400 PolarHBondContact O-N 2.91Å; I397-I400 PolarHBondContact O-N 3.41Å; G398-I400 VanDerWaalsContact C-N 3.34Å; G398-I400 PolarHBondContact O-N 2.68Å
401	K	47.6	Very low	48.8	Very low	141 Å²	141	126.3 Å²	126.3	61%	0.613	64%	0.638	S	S	*	*	H	α-helix	trans	-89.1	-6.1	177.6	-71.7	-167.7	174.6	-169.9	0	114.3	I397 G398 E399	I397-K401 PolarHBondContact O-N 3.4Å; G398-K401 PolarHBondContact O-N 3.42Å; E399-K401 VanDerWaalsContact C-N 3.25Å; E399-K401 PolarHBondContact O-N 3.11Å
402	S	40.5	Very low	47.2	Very low	78 Å²	78	130.5 Å²	130.5	55%	0.545	65%	0.65	S	S	.	*	S	Bend	trans	-76.1	127.5	175.7	76.1	0	0	0	0	110.9	G398 E399 R404	G398-S402 PolarHBondContact O-N 3.08Å; E399-S402 WeakPolarHBondContact O-CB 3.41Å; E399-S402 PolarHBondContact O-N 2.95Å; E399-S402 PolarHBondContact O-OG 2.91Å; S402-R404 PolarHBondContact O-N 3.11Å
403	S	42.2	Very low	45.8	Very low	118 Å²	118	135.2 Å²	135.2	83%	0.825	68%	0.678	S	S	*	*			trans	-78.2	62.3	-177.7	48.3	0	0	0	0	112.8	R405	S403-R405 VanDerWaalsContact C-N 3.32Å; S403-R405 PolarHBondContact O-N 3.15Å
404	R	43.4	Very low	44.8	Very low	188 Å²	188	137.4 Å²	137.4	71%	0.709	70%	0.698	S	S	*	*			trans	39.5	49.9	165.4	-157.5	-179.6	-178.2	-79.7	-11	115.2	S402 E406	S402-R404 PolarHBondContact O-N 3.11Å; R404-E406 IonicContact CZ-OE1 3.74Å; R404-E406 IonicContact NH1-OE1 2.68Å; R404-E406 PolarHBondContact NH1-OE1 2.95Å; R404-E406 IonicContact NH2-OE1 2.87Å; R404-E406 PolarHBondContact NH2-OE1 2.69Å; R404-E406 PolarHBondContact O-N 3.3Å
405	R	36.5	Very low	43.3	Very low	243 Å²	243	136.2 Å²	136.2	92%	0.917	71%	0.708	S	S	*	*			trans	-67	97.8	158.7	-84.6	-173.3	171.2	179.4	-1.6	107.7	S403	S403-R405 VanDerWaalsContact C-N 3.32Å; S403-R405 PolarHBondContact O-N 3.15Å
406	E	39.7	Very low	42.1	Very low	126 Å²	126	136.8 Å²	136.8	59%	0.589	72%	0.723	S	S	*	*			trans	-55.7	140.4	169.2	-70.8	-171.6	166.4	0	0	109.5	R404 R408	R404-E406 IonicContact CZ-OE1 3.74Å; R404-E406 IonicContact NH1-OE1 2.68Å; R404-E406 PolarHBondContact NH1-OE1 2.95Å; R404-E406 IonicContact NH2-OE1 2.87Å; R404-E406 PolarHBondContact NH2-OE1 2.69Å; R404-E406 PolarHBondContact O-N 3.3Å; E406-R408 PolarHBondContact O-N 2.65Å
407	P	48.3	Very low	41.2	Very low	120 Å²	120	138.3 Å²	138.3	78%	0.779	73%	0.734	S	S	*	*			trans	-60.5	124.1	-176.9	23.9	-33.3	0	0	0	110.1	G409	P407-G409 PolarHBondContact O-N 3.41Å
408	R	44.6	Very low	39.9	Very low	264 Å²	264	138.9 Å²	138.9	100%	0.996	74%	0.744	S	S	*	*	S	Bend	trans	-74.8	63.5	-172.8	-162.1	178.5	-170.9	178.8	1.8	111.5	E406	E406-R408 PolarHBondContact O-N 2.65Å
409	G	33.8	Very low	39.1	Very low	60 Å²	60	145.4 Å²	145.4	62%	0.619	77%	0.766	S	S	*	*	S	Bend	trans	-162.8	113.4	-174.1	0	0	0	0	0	114.9	P407	P407-G409 PolarHBondContact O-N 3.41Å
410	R	38.5	Very low	38.1	Very low	227 Å²	227	140.9 Å²	140.9	86%	0.857	76%	0.76	S	S	*	*			trans	55.7	91	169	-72.7	-178.8	169.1	156.6	-0.2	116.8	R412	R410-R412 PolarHBondContact O-N 3.22Å
411	S	33.7	Very low	37	Very low	129 Å²	129	144.9 Å²	144.9	90%	0.902	77%	0.766	S	S	*	*			trans	-54.7	94.1	150	48.9	0	0	0	0	111.7
412	R	38.4	Very low	36.4	Very low	210 Å²	210	145.1 Å²	145.1	79%	0.792	78%	0.78	S	S	*	*			trans	-125	104.2	161.1	-79.2	-168.3	168.9	-171.3	-4	109.2	R410 C414	R410-R412 PolarHBondContact O-N 3.22Å; R412-C414 PolarHBondContact O-N 3.03Å
413	S	33.2	Very low	35.9	Very low	129 Å²	129	148.3 Å²	148.3	90%	0.902	79%	0.786	S	S	*	*			trans	-69.8	81.4	-173.8	52.6	0	0	0	0	112.6
414	C	35.8	Very low	35.6	Very low	120 Å²	120	147.7 Å²	147.7	81%	0.811	79%	0.788	S	S	*	*			trans	-120.7	81.2	176.8	-70.1	0	0	0	0	111.1	R412	R412-C414 PolarHBondContact O-N 3.03Å
415	G	31.1	Very low	35.1	Very low	69 Å²	69	143.8 Å²	143.8	71%	0.711	79%	0.785	S	S	*	*			trans	68.6	65.8	164.4	0	0	0	0	0	115.4	I417	G415-I417 PolarHBondContact O-N 2.93Å
416	S	35.5	Very low	35	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	77%	0.774	S	S	*	*			trans	-56.7	110.6	147.3	177	0	0	0	0	107.2	C418	S416-C418 PolarHBondContact O-N 2.9Å
417	I	33.1	Very low	34.9	Very low	164 Å²	164	138.2 Å²	138.2	84%	0.841	78%	0.776	S	S	*	*			trans	-70.7	92.8	164.1	-62.5	179.4	0	0	0	104.8	G415 M419	G415-I417 PolarHBondContact O-N 2.93Å; I417-M419 PolarHBondContact O-N 3.33Å
418	C	27.9	Very low	34.5	Very low	89 Å²	89	141.1 Å²	141.1	60%	0.601	78%	0.78	S	S	*	*			trans	-58.4	108	176.4	-169.6	0	0	0	0	107.8	S416 G420	S416-C418 PolarHBondContact O-N 2.9Å; C418-G420 PolarHBondContact O-N 2.61Å
419	M	36.8	Very low	34.1	Very low	177 Å²	177	133.4 Å²	133.4	87%	0.872	76%	0.758	S	S	*	*			trans	-57.4	97.7	150.4	-82.4	-67.3	-66.7	0	0	105	I417 R421	I417-M419 PolarHBondContact O-N 3.33Å; M419-R421 PolarHBondContact O-N 3.29Å; M419-R421 VanDerWaalsContact O-N 3.1Å
420	G	30.1	Very low	34.5	Very low	57 Å²	57	141.3 Å²	141.3	59%	0.588	77%	0.769	S	S	*	*			trans	-53.2	120.4	-165.9	0	0	0	0	0	110.4	C418 T422	C418-G420 PolarHBondContact O-N 2.61Å; G420-T422 VanDerWaalsContact C-N 3.26Å; G420-T422 PolarHBondContact O-N 2.88Å
421	R	26.3	Very low	34.7	Very low	221 Å²	221	140 Å²	140	83%	0.834	77%	0.77	S	S	*	*			trans	-58.4	103	149	-74.3	-179.6	172.7	-175.5	-3.3	105.2	M419 E423	M419-R421 PolarHBondContact O-N 3.29Å; M419-R421 VanDerWaalsContact O-N 3.1Å; R421-E423 HydrophobicContact CB-CG 4.44Å; R421-E423 PolarHBondContact O-N 2.85Å; R421-E423 VanDerWaalsContact O-N 3.08Å
422	T	34.5	Very low	35.1	Very low	145 Å²	145	137.1 Å²	137.1	89%	0.89	75%	0.754	S	S	*	*			trans	-62.2	105.4	146.1	5.2	0	0	0	0	104.5	G420	G420-T422 VanDerWaalsContact C-N 3.26Å; G420-T422 PolarHBondContact O-N 2.88Å
423	E	29.8	Very low	35.5	Very low	145 Å²	145	132 Å²	132	68%	0.678	75%	0.746	S	S	*	*			trans	-61.4	154.7	-178.5	-65.8	166.9	146.4	0	0	109.5	R421 T425	R421-E423 HydrophobicContact CB-CG 4.44Å; R421-E423 PolarHBondContact O-N 2.85Å; R421-E423 VanDerWaalsContact O-N 3.08Å; E423-T425 HydrophobicContact CB-CG2 4.37Å; E423-T425 PolarHBondContact O-N 3.44Å
424	A	36.9	Very low	35.8	Very low	106 Å²	106	134.5 Å²	134.5	88%	0.876	74%	0.743	S	S	*	*			trans	-73.4	75.5	174.2	0	0	0	0	0	109.6	D426	A424-D426 PolarHBondContact O-N 2.91Å
425	T	32.3	Very low	36.1	Very low	105 Å²	105	137.5 Å²	137.5	64%	0.644	74%	0.743	S	S	*	*			trans	-80.7	70	174.8	54.9	0	0	0	0	110.5	E423 I427	E423-T425 HydrophobicContact CB-CG2 4.37Å; E423-T425 PolarHBondContact O-N 3.44Å; T425-I427 VanDerWaalsContact C-N 3.29Å; T425-I427 PolarHBondContact O-N 3.39Å
426	D	34.7	Very low	36.6	Very low	127 Å²	127	142.1 Å²	142.1	68%	0.679	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	88.1	161.2	171.2	20.8	0	0	0	109.5	A424	A424-D426 PolarHBondContact O-N 2.91Å
427	I	38.3	Very low	36.4	Very low	125 Å²	125	147 Å²	147	64%	0.641	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.9	-35.7	179.7	-61	-175.1	0	0	0	112.6	T425 D429 R430	T425-I427 VanDerWaalsContact C-N 3.29Å; T425-I427 PolarHBondContact O-N 3.39Å; I427-D429 PolarHBondContact O-N 3.5Å; I427-R430 PolarHBondContact O-N 3.32Å
428	E	38.8	Very low	36.5	Very low	181 Å²	181	146 Å²	146	85%	0.846	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-24.8	-176.9	-69.3	-154	120.5	0	0	114.4	R430 K431	E428-R430 PolarHBondContact O-N 2.85Å; E428-K431 PolarHBondContact O-N 3.5Å
429	D	37.3	Very low	37	Very low	103 Å²	103	151.4 Å²	151.4	55%	0.551	76%	0.762	S	S	*	*	H	α-helix	trans	-64.3	-23	177.4	-90.7	-38.1	0	0	0	113.1	I427 K431 A432 V433	I427-D429 PolarHBondContact O-N 3.5Å; D429-K431 PolarHBondContact O-N 3.18Å; D429-K431 VanDerWaalsContact O-N 3.11Å; D429-A432 PolarHBondContact O-N 2.87Å; D429-V433 HydrophobicContact CB-CG2 4.19Å; D429-V433 WeakPolarHBondContact O-CB 3.33Å; D429-V433 VanDerWaalsContact O-CG2 3.29Å; D429-V433 WeakPolarHBondContact O-CG2 3.41Å; D429-V433 PolarHBondContact O-N 3.19Å
430	R	42.2	Very low	36.5	Very low	226 Å²	226	149.5 Å²	149.5	85%	0.853	76%	0.76	S	S	*	*	H	α-helix	trans	-72.8	5.2	176.9	-85.5	-167.9	173.2	-152.4	-2.3	115.8	I427 E428	I427-R430 PolarHBondContact O-N 3.32Å; E428-R430 PolarHBondContact O-N 2.85Å
431	K	41.2	Very low	37.5	Very low	198 Å²	198	151.9 Å²	151.9	86%	0.861	77%	0.766	S	S	*	*	H	α-helix	trans	-124.4	-14.5	164.8	-74.8	-171.9	176.7	178.5	0	115.6	E428 D429	E428-K431 PolarHBondContact O-N 3.5Å; D429-K431 PolarHBondContact O-N 3.18Å; D429-K431 VanDerWaalsContact O-N 3.11Å
432	A	43.3	Very low	37.8	Very low	70 Å²	70	147.3 Å²	147.3	58%	0.579	76%	0.764	S	S	*	*	H	α-helix	trans	-84.2	-42.9	174.1	0	0	0	0	0	112.6	D429 Q434	D429-A432 PolarHBondContact O-N 2.87Å; A432-Q434 PolarHBondContact O-N 2.74Å; A432-Q434 VanDerWaalsContact O-N 3.11Å
433	V	46.3	Very low	37.2	Very low	101 Å²	101	149.3 Å²	149.3	61%	0.612	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-16.2	-168	175.3	0	0	0	0	113.9	D429	D429-V433 HydrophobicContact CB-CG2 4.19Å; D429-V433 WeakPolarHBondContact O-CB 3.33Å; D429-V433 VanDerWaalsContact O-CG2 3.29Å; D429-V433 WeakPolarHBondContact O-CG2 3.41Å; D429-V433 PolarHBondContact O-N 3.19Å
434	Q	40.3	Very low	37.5	Very low	183 Å²	183	146.7 Å²	146.7	86%	0.855	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	2.5	-173.9	-144.5	179.6	13.7	0	0	116	A432	A432-Q434 PolarHBondContact O-N 2.74Å; A432-Q434 VanDerWaalsContact O-N 3.11Å
435	K	42.2	Very low	37	Very low	183 Å²	183	150 Å²	150	80%	0.796	76%	0.764	S	S	*	*	S	Bend	trans	-126.8	2.4	-177.1	-137.7	-173.7	178.5	179.7	0	118.6
436	N	41.1	Very low	36.7	Very low	165 Å²	165	150.1 Å²	150.1	88%	0.882	77%	0.769	S	S	*	*			trans	-145.9	59.3	170.3	-88.2	-46	0	0	0	112.8
437	R	31.3	Very low	36.3	Very low	215 Å²	215	150.9 Å²	150.9	81%	0.811	77%	0.772	S	S	*	*			trans	-85.2	149.1	150.8	-103	-180	170.1	170.7	-3.9	108.5
438	N	35.1	Very low	35.7	Very low	143 Å²	143	150.3 Å²	150.3	77%	0.765	78%	0.779	S	S	*	*			trans	69.9	114	171	-40.8	-24.8	0	0	0	113.6
439	K	37.2	Very low	35.4	Very low	203 Å²	203	146.8 Å²	146.8	88%	0.883	77%	0.771	S	S	*	*				-158.7	147.3	55.5	-78	173.5	176.1	179.1	0	112.4
440	T	28.3	Very low	34.8	Very low	138 Å²	138	146.8 Å²	146.8	85%	0.847	78%	0.779	S	S	*	*			trans	-94.7	-174.2	174.9	-13.5	0	0	0	0	110.5
441	P	50.3	Low	34.1	Very low	107 Å²	107	142 Å²	142	70%	0.695	77%	0.77	S	S	*	*				-115.9	-179.9	-123.2	42.9	-28.7	0	0	0	114.6
442	P	32.4	Very low	33.4	Very low	125 Å²	125	139 Å²	139	81%	0.812	76%	0.759	S	S	*	*			trans	-101.8	125.2	155	33.6	-24.9	0	0	0	111.9
443	Q	22.9	Very low	32.7	Very low	187 Å²	187	142.2 Å²	142.2	87%	0.874	77%	0.767	S	S	*	*			trans	-85.4	122.1	153.6	-93.3	-170.7	-19.1	0	0	109
444	A	35.6	Very low	31.9	Very low	90 Å²	90	143.7 Å²	143.7	74%	0.744	77%	0.769	S	S	*	*			trans	-156.7	111.8	153.7	0	0	0	0	0	104.7
445	Q	24.9	Very low	31.4	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	77%	0.767	S	S	*	*				54.3	136.5	60	-67.3	-154.4	6.9	0	0	114.8
446	S	26.7	Very low	31	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	77%	0.766	S	S	*	*			trans	90.7	131	163.1	84	0	0	0	0	119.4
447	I	27.3	Very low	30.6	Very low	144 Å²	144	139.4 Å²	139.4	74%	0.738	76%	0.76	S	S	*	*			trans	67.6	91.3	142.3	-59.8	159.4	0	0	0	117.3	P449	I447-P449 HydrophobicContact CG2-CG 4.47Å
448	S	25.1	Very low	30.6	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	76%	0.76	S	S	*	*			trans	-59.3	144.7	137.6	54.4	0	0	0	0	110.5
449	P	32.9	Very low	30.4	Very low	106 Å²	106	137.3 Å²	137.3	69%	0.688	76%	0.764	S	S	*	*				-147.7	159.5	122.4	40.1	-26	0	0	0	114.6	I447	I447-P449 HydrophobicContact CG2-CG 4.47Å
450	S	24.8	Very low	30	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	76%	0.759	S	S	*	*				66.1	145.1	129.3	176.1	0	0	0	0	121.9
451	L	26.2	Very low	30	Very low	125 Å²	125	135.4 Å²	135.4	65%	0.654	76%	0.757	S	S	*	*			cis	-171	172	-20.3	-103.3	171.7	0	0	0	106.4
452	H	26.4	Very low	28.9	Very low	136 Å²	136	132.9 Å²	132.9	63%	0.63	75%	0.751	S	S	*	*			trans	66.3	152.4	155	-67.2	-48.2	0	0	0	117.8
453	N	30.4	Very low	28.6	Very low	138 Å²	138	128.9 Å²	128.9	74%	0.738	73%	0.732	S	S	*	*			cis	-124.3	157.5	-7	-81.4	-52.3	0	0	0	108.3
454	I	28	Very low	28.8	Very low	131 Å²	131	127.4 Å²	127.4	67%	0.672	73%	0.725	S	S	*	*			cis	71.8	75.6	25.2	-46.1	-175.6	0	0	0	115.6
455	E	30.8	Very low	28.6	Very low	172 Å²	172	131.5 Å²	131.5	80%	0.804	73%	0.726	S	S	*	*			trans	-160.4	159.8	148	-80.9	-142.3	124.3	0	0	108.8
456	K	33.6	Very low	28.7	Very low	177 Å²	177	128.7 Å²	128.7	77%	0.77	72%	0.721	S	S	*	*			cis	-173.3	159.6	-44.1	-118.2	176.2	-178	173.4	0	107.8
457	A	32.1	Very low	28.6	Very low	92 Å²	92	130.7 Å²	130.7	76%	0.76	72%	0.723	S	S	*	*			trans	80.9	145.2	162	0	0	0	0	0	121.7
458	N	31	Very low	28.5	Very low	152 Å²	152	132.6 Å²	132.6	81%	0.813	73%	0.726	S	S	*	*			trans	76.1	132.4	173.9	-60.9	11.3	0	0	0	118
459	L	31.7	Very low	28.6	Very low	163 Å²	163	135.7 Å²	135.7	85%	0.853	73%	0.73	S	S	*	*			cis	-155	161.8	-22.6	-166.6	59.7	0	0	0	108.9
460	V	28.5	Very low	28.4	Very low	126 Å²	126	135.9 Å²	135.9	76%	0.764	74%	0.74	S	S	*	*			trans	-83.2	137.5	-178.4	169.6	0	0	0	0	111.9
461	E	28.8	Very low	28.3	Very low	174 Å²	174	139.1 Å²	139.1	81%	0.813	75%	0.749	S	S	*	*				-164.4	133.5	124.4	-110.4	-167.9	155.1	0	0	114.1
462	G	26.6	Very low	28.4	Very low	55 Å²	55	135.6 Å²	135.6	57%	0.567	74%	0.743	S	S	*	*			trans	-70.4	179.3	-159.4	0	0	0	0	0	117.6	R799	G462-R799 VanDerWaalsContact O-CZ 3.28Å; G462-R799 PolarHBondContact O-NH1 3.12Å; G462-R799 PolarHBondContact O-NH2 2.79Å
463	G	26.9	Very low	28.4	Very low	41 Å²	41	131.3 Å²	131.3	42%	0.423	73%	0.729	S	S	.	*			trans	162.2	28.9	171.9	0	0	0	0	0	122.9	R798	G463-R798 PolarHBondContact O-NH1 2.83Å
464	Q	26.8	Very low	28.3	Very low	155 Å²	155	129.2 Å²	129.2	72%	0.724	71%	0.714	S	S	*	*			trans	62.6	143	164.9	-54.6	169.7	0.8	0	0	117.4
465	K	30.8	Very low	28.2	Very low	177 Å²	177	129.5 Å²	129.5	77%	0.77	71%	0.711	S	S	*	*			cis	-145.3	132.2	-1.9	-114.2	171.5	179	179.2	0	105.6
466	V	27.8	Very low	28.1	Very low	117 Å²	117	123.4 Å²	123.4	71%	0.709	69%	0.69	S	S	*	*				59.8	104.4	100	175.4	0	0	0	0	111.5
467	L	25.4	Very low	27.9	Very low	148 Å²	148	122.6 Å²	122.6	78%	0.775	69%	0.689	S	S	*	*				60.1	143.8	66.1	-64.2	157.5	0	0	0	111.9
468	K	24	Very low	27.6	Very low	184 Å²	184	123.4 Å²	123.4	80%	0.8	68%	0.677	S	S	*	*			cis	-154.9	171.6	-5.1	-146.4	175.1	-176.2	180	0	108.8
469	M	27.5	Very low	27.8	Very low	178 Å²	178	121.3 Å²	121.3	88%	0.877	67%	0.672	S	S	*	*			trans	-36.7	142.5	162.9	-48.8	-81.5	-79.7	0	0	115.5
470	A	28.6	Very low	27.5	Very low	109 Å²	109	121.6 Å²	121.6	90%	0.901	67%	0.669	S	S	*	*			trans	-165.8	157.9	145.7	0	0	0	0	0	110.5
471	D	23.5	Very low	27.8	Very low	171 Å²	171	122.1 Å²	122.1	91%	0.914	67%	0.672	S	S	*	*			trans	-130.6	154.8	-163.8	-142.7	-39.6	0	0	0	115.3
472	G	27.7	Very low	27.9	Very low	52 Å²	52	120.6 Å²	120.6	54%	0.536	68%	0.675	S	S	.	*			trans	95.4	159.3	161.4	0	0	0	0	0	119
473	S	27.1	Very low	28	Very low	46 Å²	46	122.3 Å²	122.3	32%	0.322	68%	0.684	S	S	.	*			cis	152.1	-173.2	-13.5	49.2	0	0	0	0	108.9	K36	K36-S473 VanDerWaalsContact CE-C 3.48Å; K36-S473 VanDerWaalsContact CE-O 3.25Å; K36-S473 WeakPolarHBondContact CE-O 3.41Å; K36-S473 WeakPolarHBondContact CE-OG 2.96Å; K36-S473 WeakPolarHBondContact CG-OG 3.33Å; K36-S473 PolarHBondContact NZ-O 3.35Å
474	Q	27.6	Very low	28.2	Very low	93 Å²	93	127.2 Å²	127.2	44%	0.435	71%	0.706	S	S	.	*			trans	80.5	159.3	-170.2	-91.1	169.2	-23.2	0	0	115.8	F33 P35 K36	F33-Q474 WeakPolarHBondContact CE1-O 3.32Å; P35-Q474 HydrophobicContact CB-CG 3.61Å; K36-Q474 HydrophobicContact CB-CG 4.46Å; K36-Q474 HydrophobicContact CD-CB 4.44Å; K36-Q474 HydrophobicContact CD-CG 3.76Å; K36-Q474 HydrophobicContact CG-CG 4.02Å
475	K	26	Very low	29	Very low	137 Å²	137	125.2 Å²	125.2	60%	0.596	71%	0.706	S	S	*	*			cis	-162.7	147.9	-21.8	-154.4	179.7	-174	-168.9	0	113.2	R34 P35	R34-K475 WeakPolarHBondContact O-CA 3.18Å; P35-K475 HydrophobicContact CB-CG 4.02Å; P35-K475 HydrophobicContact CG-CG 4.15Å
476	A	28.3	Very low	29.1	Very low	45 Å²	45	126.5 Å²	126.5	37%	0.372	71%	0.712	S	S	.	*			trans	48.1	170.8	161.9	0	0	0	0	0	119.9	F33	F33-A476 VanDerWaalsContact CB-N 3.34Å; F33-A476 WeakPolarHBondContact CB-O 3.46Å; F33-A476 WeakPolarHBondContact CD2-O 3.4Å; F33-A476 WeakPolarHBondContact CG-O 3.5Å
477	Q	30.3	Very low	29.4	Very low	159 Å²	159	126 Å²	126	74%	0.743	71%	0.711	S	S	*	*			cis	-136.1	170.6	-1.2	-88.5	-170.7	-126.8	0	0	109.3
478	Q	24.3	Very low	30	Very low	110 Å²	110	125.1 Å²	125.1	51%	0.514	71%	0.714	S	S	.	*			cis	102.1	85.9	4.3	-159.3	172.5	-11.6	0	0	117.7	Y31	Y31-Q478 WeakPolarHBondContact OH-CA 3.34Å; Y31-Q478 VanDerWaalsContact OH-CB 3.23Å; Y31-Q478 WeakPolarHBondContact OH-CB 3.14Å; Y31-Q478 PolarHBondContact OH-N 3.44Å
479	P	36	Very low	30.7	Very low	108 Å²	108	122.8 Å²	122.8	70%	0.701	72%	0.715	S	S	*	*				-133.6	162	115.5	39.5	-30.5	0	0	0	112.6
480	Q	25.7	Very low	31	Very low	169 Å²	169	119.6 Å²	119.6	79%	0.79	72%	0.717	S	S	*	*			cis	81.8	105.9	19.7	-79.3	-162.2	-17.3	0	0	119.3
481	T	33.5	Very low	31.3	Very low	137 Å²	137	118 Å²	118	84%	0.84	70%	0.703	S	S	*	*			trans	-157.9	120.2	146.8	17.3	0	0	0	0	112.9
482	T	31.5	Very low	31.8	Very low	142 Å²	142	118 Å²	118	87%	0.871	70%	0.703	S	S	*	*			trans	29.3	152.1	144.9	35.1	0	0	0	0	125.1
483	A	27.9	Very low	32.2	Very low	90 Å²	90	122.2 Å²	122.2	74%	0.744	72%	0.718	S	S	*	*			trans	-137.9	159.7	179.3	0	0	0	0	0	113.3
484	T	31.2	Very low	32.6	Very low	145 Å²	145	125.6 Å²	125.6	89%	0.89	74%	0.739	S	S	*	*			trans	-174	153.6	145.2	13.8	0	0	0	0	111.9
485	P	43.7	Very low	32.8	Very low	113 Å²	113	127.3 Å²	127.3	73%	0.734	75%	0.751	S	S	*	*			trans	-118.8	160.2	-173	41.1	-31.6	0	0	0	116.2
486	K	33.1	Very low	33.4	Very low	203 Å²	203	129 Å²	129	88%	0.883	77%	0.765	S	S	*	*			trans	171.9	165.2	160	-100.6	156.5	-176.3	178.2	0	110.1
487	P	34.6	Very low	33.6	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	78%	0.783	S	S	*	*			cis	-123.9	173.7	-41.4	38.1	-23.1	0	0	0	111.6
488	P	37	Very low	33.7	Very low	129 Å²	129	138.4 Å²	138.4	84%	0.838	79%	0.791	S	S	*	*			trans	-82	142.4	-178.2	32.4	-35	0	0	0	113.8
489	V	39.5	Very low	34.3	Very low	136 Å²	136	138.9 Å²	138.9	82%	0.824	81%	0.807	S	S	*	*			trans	-101.2	101.8	174.2	-179.9	0	0	0	0	110.3	A491	V489-A491 HydrophobicContact CG1-CB 4.21Å
490	A	33.2	Very low	34.1	Very low	110 Å²	110	143.1 Å²	143.1	91%	0.909	81%	0.814	S	S	*	*			trans	-97.4	91.5	166.6	0	0	0	0	0	109.5
491	A	36.4	Very low	34.3	Very low	75 Å²	75	140.7 Å²	140.7	62%	0.62	81%	0.811	S	S	*	*			trans	-149.4	160.5	173.9	0	0	0	0	0	110.1	V489	V489-A491 HydrophobicContact CG1-CB 4.21Å
492	L	33.9	Very low	34.4	Very low	172 Å²	172	140.5 Å²	140.5	90%	0.901	81%	0.812	S	S	*	*			trans	70.5	48.4	177.6	-57.3	167.7	0	0	0	116.6
493	V	36.1	Very low	34.5	Very low	141 Å²	141	142.4 Å²	142.4	86%	0.855	81%	0.808	S	S	*	*			trans	-113.1	114.5	140.3	179.3	0	0	0	0	107.1
494	P	34.5	Very low	34.6	Very low	117 Å²	117	146.9 Å²	146.9	76%	0.76	81%	0.813	S	S	*	*			trans	-77.3	135.7	-176.8	30	-33.5	0	0	0	111.9
495	D	33.3	Very low	35.4	Very low	128 Å²	128	145 Å²	145	68%	0.684	80%	0.804	S	S	*	*			trans	-66.4	127	177.2	-129.6	-18.9	0	0	0	111.3	Q497	D495-Q497 HydrophobicContact CB-CG 4.26Å
496	L	37.6	Very low	34.5	Very low	173 Å²	173	143.6 Å²	143.6	91%	0.906	81%	0.809	S	S	*	*			trans	-117.7	92.5	159.1	-87.2	173.2	0	0	0	108.1
497	Q	33.5	Very low	34.5	Very low	158 Å²	158	136.1 Å²	136.1	74%	0.738	79%	0.79	S	S	*	*			trans	-67.2	142.8	-165.3	-64.5	-179.9	-11.2	0	0	113.2	D495 S499	D495-Q497 HydrophobicContact CB-CG 4.26Å; Q497-S499 PolarHBondContact O-N 3.47Å
498	R	32.1	Very low	34.4	Very low	243 Å²	243	137.4 Å²	137.4	92%	0.917	80%	0.796	S	S	*	*			trans	-69.6	105.8	171.6	-66.3	175.3	175.7	174.1	-2.3	110.3
499	S	36.7	Very low	34.2	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	77%	0.769	S	S	*	*			trans	-68.4	133.9	170.6	51.8	0	0	0	0	111.3	Q497	Q497-S499 PolarHBondContact O-N 3.47Å
500	K	31.5	Very low	33.7	Very low	197 Å²	197	131.4 Å²	131.4	86%	0.857	76%	0.755	S	S	*	*			trans	-96.2	123.7	177.9	-70.3	178.1	-179.6	173.4	0	110.8
501	V	30.2	Very low	33.6	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.715	74%	0.737	S	S	*	*			trans	12	130.3	145.7	-169.8	0	0	0	0	117.8	K503	V501-K503 HydrophobicContact CG1-CG 3.95Å
502	P	34.2	Very low	33.8	Very low	132 Å²	132	132.1 Å²	132.1	86%	0.857	74%	0.74	S	S	*	*				-118.7	151.7	119.1	34.5	-33.2	0	0	0	113
503	K	35.2	Very low	33.9	Very low	183 Å²	183	131.9 Å²	131.9	80%	0.796	73%	0.734	S	S	*	*			trans	-102.3	155.8	178.2	-78.7	-178.3	175.5	178	0	111.8	V501	V501-K503 HydrophobicContact CG1-CG 3.95Å
504	Q	29	Very low	34.2	Very low	183 Å²	183	131.7 Å²	131.7	86%	0.855	73%	0.733	S	S	*	*			trans	66.4	168.9	156.6	-83.5	-164.5	4.8	0	0	118.8
505	P	48	Very low	34.2	Very low	107 Å²	107	134.1 Å²	134.1	70%	0.695	73%	0.732	S	S	*	*			cis	-120.5	177.8	-15.6	17.1	6.1	0	0	0	113.7
506	G	25.5	Very low	34.3	Very low	82 Å²	82	136.2 Å²	136.2	85%	0.845	74%	0.735	S	S	*	*			trans	-71.2	165.7	173.2	0	0	0	0	0	114.1
507	G	33.6	Very low	34.2	Very low	46 Å²	46	134.4 Å²	134.4	47%	0.474	72%	0.721	S	S	.	*			trans	166.7	125.7	175.2	0	0	0	0	0	113.5	K966	G507-K966 PolarHBondContact O-NZ 3.45Å
508	T	31.9	Very low	33.9	Very low	134 Å²	134	136 Å²	136	82%	0.822	73%	0.726	S	S	*	*			trans	-86.2	176.2	-162.9	44.6	0	0	0	0	115.9	K967	T508-K967 WeakPolarHBondContact O-CE 3.38Å
509	G	32.4	Very low	33.9	Very low	26 Å²	26	129.8 Å²	129.8	27%	0.268	72%	0.717	S	S	.	*			trans	120	94.3	172.7	0	0	0	0	0	112.5	K967	G509-K967 WeakPolarHBondContact O-CA 3.27Å; G509-K967 WeakPolarHBondContact O-CG 3.32Å; G509-K967 PolarHBondContact O-N 2.84Å; G509-K967 VanDerWaalsContact O-N 3.1Å
510	Q	29.5	Very low	34.1	Very low	114 Å²	114	128 Å²	128	53%	0.533	71%	0.709	S	S	.	*				71.4	119	81.3	-87.9	-147.4	41.7	0	0	116.1	K967 T968 T969	Q510-K967 CarbonylContact O-C 3.41Å; Q510-K967 WeakPolarHBondContact O-CA 3.35Å; Q510-T968 CarbonylContact O-C 3.53Å; Q510-T968 VanDerWaalsContact O-CA 3.24Å; Q510-T968 WeakPolarHBondContact O-CA 3.09Å; Q510-T968 PolarHBondContact O-N 3.25Å; Q510-T969 VanDerWaalsContact CB-OG1 3.23Å; Q510-T969 WeakPolarHBondContact CB-OG1 2.95Å; Q510-T969 PolarHBondContact OE1-OG1 3.35Å
511	T	30	Very low	34	Very low	86 Å²	86	122.7 Å²	122.7	53%	0.528	69%	0.691	S	S	.	*			trans	61.7	136.7	130.2	-27.9	0	0	0	0	121.4	T968	T511-T968 CarbonylContact O-C 3.49Å; T511-T968 PolarHBondContact O-N 3.27Å
512	V	40.5	Very low	34.7	Very low	114 Å²	114	120.5 Å²	120.5	69%	0.691	69%	0.685	S	S	*	*				-179.8	141.6	126.2	149.1	0	0	0	0	108.7
513	E	36.1	Very low	35.3	Very low	167 Å²	167	121.9 Å²	121.9	78%	0.78	68%	0.677	S	S	*	*			trans	-90	130.1	176.6	-69.6	-174	109.5	0	0	113.4
514	V	42.6	Very low	35.6	Very low	137 Å²	137	116.9 Å²	116.9	83%	0.83	66%	0.664	S	S	*	*			trans	-134.4	110.3	153.7	-176.4	0	0	0	0	106.6
515	K	34.6	Very low	36.3	Very low	167 Å²	167	117.1 Å²	117.1	73%	0.726	67%	0.665	S	S	*	*			cis	75.4	71.2	24.9	-158	-172.7	-175.7	173	0	114.7
516	K	36.8	Very low	35.9	Very low	172 Å²	172	114.6 Å²	114.6	75%	0.748	66%	0.658	S	S	*	*				179.9	157.6	123.2	-103.9	172.9	169.6	-169	0	115.9
517	H	33.9	Very low	36.2	Very low	135 Å²	135	115.2 Å²	115.2	63%	0.625	64%	0.641	S	S	*	*			trans	42.4	123	161.7	-56.3	-63.3	0	0	0	120.1
518	F	26.9	Very low	36.2	Very low	192 Å²	192	121.7 Å²	121.7	84%	0.842	66%	0.656	S	S	*	*				67.7	146.8	53.7	-72.6	-70.8	0	0	0	113.5
519	P	33.6	Very low	36.2	Very low	113 Å²	113	123.9 Å²	123.9	73%	0.734	66%	0.657	S	S	*	*			cis	-129.1	-164.2	2.9	40.3	-22.5	0	0	0	114.3
520	A	40.4	Very low	36.4	Very low	82 Å²	82	129.7 Å²	129.7	68%	0.678	69%	0.687	S	S	*	*			trans	18.8	133	150.7	0	0	0	0	0	119.9
521	N	30.3	Very low	36.7	Very low	86 Å²	86	133.8 Å²	133.8	46%	0.46	70%	0.703	S	S	.	*			cis	-115.1	157.3	34.6	-107.7	-39.2	0	0	0	116.9	S948	N521-S948 VanDerWaalsContact CB-C 3.46Å; N521-S948 VanDerWaalsContact CB-O 3.26Å; N521-S948 WeakPolarHBondContact CB-O 3.34Å; N521-S948 PolarHBondContact ND2-N 3.11Å; N521-S948 PolarHBondContact ND2-O 3.38Å
522	A	43.8	Very low	37.1	Very low	72 Å²	72	136.6 Å²	136.6	60%	0.595	72%	0.72	S	S	*	*			trans	-64.3	139.2	-172.4	0	0	0	0	0	113.3	P524	A522-P524 VanDerWaalsContact O-CD 3.24Å; A522-P524 WeakPolarHBondContact O-CD 3.44Å
523	K	47.6	Very low	37	Very low	161 Å²	161	140.7 Å²	140.7	70%	0.7	73%	0.729	S	S	*	*			trans	-78.7	107.8	160.1	-61.2	-178.2	-177.9	-177.5	0	106.8	E525 D871	K523-E525 PolarHBondContact O-N 2.82Å; K523-D871 IonicContact NZ-OD1 2.63Å; K523-D871 PolarHBondContact NZ-OD1 3.01Å; K523-D871 IonicContact NZ-OD2 2.67Å
524	P	40.9	Very low	37.4	Very low	79 Å²	79	138.5 Å²	138.5	51%	0.513	73%	0.729	S	S	.	*			trans	-67.5	128.6	175.7	29.2	-34.4	0	0	0	109.2	A522 V946	A522-P524 VanDerWaalsContact O-CD 3.24Å; A522-P524 WeakPolarHBondContact O-CD 3.44Å; P524-V946 HydrophobicContact CB-CG1 4.13Å; P524-V946 HydrophobicContact CB-CG2 4.19Å; P524-V946 HydrophobicContact CG-CG1 3.9Å
525	E	43.2	Very low	37.1	Very low	188 Å²	188	140.9 Å²	140.9	88%	0.879	73%	0.731	S	S	*	*			trans	65.8	129	179.8	-56.3	174.6	-167.8	0	0	112.8	K523	K523-E525 PolarHBondContact O-N 2.82Å
526	G	39.3	Very low	37.9	Very low	54 Å²	54	137.5 Å²	137.5	56%	0.557	73%	0.726	S	S	*	*				95.8	91.2	57	0	0	0	0	0	106.8
527	I	33.1	Very low	38.4	Very low	95 Å²	95	132.2 Å²	132.2	49%	0.487	72%	0.721	S	S	.	*				-164	142.6	86	-94.3	157.7	0	0	0	111.9	T868 R869	I527-T868 HydrophobicContact CB-CG2 4.41Å; I527-R869 WeakPolarHBondContact O-CD 3.33Å
528	K	33.4	Very low	39	Very low	181 Å²	181	133.7 Å²	133.7	79%	0.787	73%	0.728	S	S	*	*			trans	47.9	151.8	153.4	-66.4	173.4	-175	178.3	0	122.8	R869	K528-R869 PolarHBondContact O-NH1 2.83Å
529	Q	30.7	Very low	40.3	Very low	181 Å²	181	128.3 Å²	128.3	85%	0.846	71%	0.71	S	S	*	*			trans	-87.9	155.5	-176.8	-56.9	152.7	-26.9	0	0	112
530	V	37.7	Very low	40.9	Very low	147 Å²	147	128.4 Å²	128.4	89%	0.891	70%	0.704	S	S	*	*			trans	-139.7	146.7	156.5	-176.8	0	0	0	0	108
531	K	36.2	Very low	41.5	Very low	201 Å²	201	131 Å²	131	87%	0.874	70%	0.702	S	S	*	*			trans	-80.8	148.8	-177.3	-57.7	178.9	-179.8	-177.6	0	111.6
532	T	36.9	Very low	42.7	Very low	144 Å²	144	135.2 Å²	135.2	88%	0.883	72%	0.716	S	S	*	*			trans	-81.1	146.5	161	37	0	0	0	0	110.9
533	K	39.7	Very low	43.4	Very low	201 Å²	201	135.6 Å²	135.6	87%	0.874	71%	0.706	S	S	*	*			trans	-142.1	168.9	174	-112	-164.8	175.4	-167.1	0	108.2
534	P	42.9	Very low	44	Very low	121 Å²	121	131.7 Å²	131.7	79%	0.786	70%	0.696	S	S	*	*			trans	-72.8	166.7	-152	28.3	-37.1	0	0	0	116.3
535	E	37.1	Very low	45	Very low	187 Å²	187	133.1 Å²	133.1	87%	0.874	70%	0.695	S	S	*	*			trans	-71.4	153.1	-172	-62.6	-167.4	139.6	0	0	114.9
536	P	51.4	Low	46.6	Very low	96 Å²	96	127.2 Å²	127.2	62%	0.623	68%	0.675	S	S	*	*			trans	-105.4	12.8	-170.1	14	9.5	0	0	0	114.3	H538 V539	P536-H538 PolarHBondContact O-N 3.23Å; P536-V539 WeakPolarHBondContact O-CB 3.31Å; P536-V539 WeakPolarHBondContact O-CG2 3.42Å; P536-V539 PolarHBondContact O-N 3.39Å
537	G	47.9	Very low	48.3	Very low	61 Å²	61	129.7 Å²	129.7	63%	0.629	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-22.5	-164.9	0	0	0	0	0	116.4
538	H	47	Very low	50.5	Low	166 Å²	166	131.9 Å²	131.9	77%	0.769	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-9.4	-179.6	-131.7	-43.6	0	0	0	114.9	P536	P536-H538 PolarHBondContact O-N 3.23Å
539	V	52.7	Low	52.7	Low	79 Å²	79	131.9 Å²	131.9	48%	0.479	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.1	-37.6	-175.5	-178.1	0	0	0	0	112	P536 Q541 K542	P536-V539 WeakPolarHBondContact O-CB 3.31Å; P536-V539 WeakPolarHBondContact O-CG2 3.42Å; P536-V539 PolarHBondContact O-N 3.39Å; V539-Q541 VanDerWaalsContact C-N 3.34Å; V539-Q541 PolarHBondContact O-N 2.88Å; V539-K542 PolarHBondContact O-N 3.46Å
540	L	47.7	Very low	55.2	Low	114 Å²	114	126.7 Å²	126.7	60%	0.597	65%	0.651	S	S	*	*	H	α-helix	trans	-61.9	-31.7	-166.3	-68.4	170.1	0	0	0	114.8	E543 T544	L540-E543 WeakPolarHBondContact O-CB 2.87Å; L540-E543 PolarHBondContact O-N 3.39Å; L540-T544 PolarHBondContact O-N 3Å
541	Q	51.6	Low	57.4	Low	138 Å²	138	125.3 Å²	125.3	65%	0.645	64%	0.638	S	S	*	*	H	α-helix	trans	-69.7	-34	179.4	-74.3	-174.4	-51.6	0	0	113.2	V539 E543 T544 E545	V539-Q541 VanDerWaalsContact C-N 3.34Å; V539-Q541 PolarHBondContact O-N 2.88Å; Q541-E543 PolarHBondContact O-N 3.29Å; Q541-T544 PolarHBondContact O-N 2.72Å; Q541-T544 PolarHBondContact O-OG1 3.18Å; Q541-E545 PolarHBondContact O-N 3.37Å
542	K	56.7	Low	59.6	Low	174 Å²	174	118.2 Å²	118.2	76%	0.757	62%	0.617	S	S	*	*	H	α-helix	trans	-70.6	-24.8	175.4	-68.1	-169.9	175.3	-173.2	0	112.1	V539 S546	V539-K542 PolarHBondContact O-N 3.46Å; K542-S546 PolarHBondContact O-N 3.37Å; K542-S546 PolarHBondContact O-OG 3.38Å
543	E	57.7	Low	61.7	Low	80 Å²	80	114.1 Å²	114.1	37%	0.374	60%	0.598	S	S	.	*	H	α-helix	trans	-75.6	-33.1	172.3	-78.7	-167.6	-141.4	0	0	113.6	L540 Q541 S546 K547	L540-E543 WeakPolarHBondContact O-CB 2.87Å; L540-E543 PolarHBondContact O-N 3.39Å; Q541-E543 PolarHBondContact O-N 3.29Å; E543-S546 WeakPolarHBondContact CA-OG 3.29Å; E543-S546 PolarHBondContact O-OG 3.11Å; E543-S546 VanDerWaalsContact O-OG 3.08Å; E543-K547 WeakPolarHBondContact O-CB 3.41Å; E543-K547 VanDerWaalsContact O-CD 3.23Å; E543-K547 WeakPolarHBondContact O-CD 3.41Å; E543-K547 WeakPolarHBondContact O-CE 3.32Å; E543-K547 WeakPolarHBondContact O-CG 3.22Å; E543-K547 PolarHBondContact O-N 3.11Å; E543-K547 IonicContact OE2-NZ 3.83Å; E543-K547 PolarHBondContact OE2-NZ 3.26Å
544	T	60.9	Low	63.7	Low	79 Å²	79	109.2 Å²	109.2	49%	0.485	58%	0.581	S	S	.	*	H	α-helix	trans	-71.2	-44.3	179	43.3	0	0	0	0	111.8	L540 Q541 S546 K547 E548	L540-T544 PolarHBondContact O-N 3Å; Q541-T544 PolarHBondContact O-N 2.72Å; Q541-T544 PolarHBondContact O-OG1 3.18Å; T544-S546 VanDerWaalsContact C-N 3.33Å; T544-S546 PolarHBondContact O-N 2.87Å; T544-K547 PolarHBondContact O-N 3.03Å; T544-E548 PolarHBondContact O-N 3.27Å; T544-E548 VanDerWaalsContact O-N 3.07Å
545	E	61.6	Low	65.6	Low	108 Å²	108	105.8 Å²	105.8	51%	0.505	56%	0.562	S	S	.	*	H	α-helix	trans	-64.5	-35.2	178.2	-68.7	-177.3	-152.7	0	0	113	Q541 R549	Q541-E545 PolarHBondContact O-N 3.37Å; E545-R549 VanDerWaalsContact O-CG 3.29Å; E545-R549 WeakPolarHBondContact O-CG 3.29Å; E545-R549 PolarHBondContact O-N 3.12Å; E545-R549 VanDerWaalsContact O-N 3.13Å; E545-R549 IonicContact OE2-NH2 2.85Å
546	S	75.7	Confident	67.9	Low	64 Å²	64	102.4 Å²	102.4	45%	0.448	55%	0.547	S	S	.	.	H	α-helix	trans	-71.6	-35	176.6	56	0	0	0	0	112.4	K542 E543 T544 L550	K542-S546 PolarHBondContact O-N 3.37Å; K542-S546 PolarHBondContact O-OG 3.38Å; E543-S546 WeakPolarHBondContact CA-OG 3.29Å; E543-S546 PolarHBondContact O-OG 3.11Å; E543-S546 VanDerWaalsContact O-OG 3.08Å; T544-S546 VanDerWaalsContact C-N 3.33Å; T544-S546 PolarHBondContact O-N 2.87Å; S546-L550 WeakPolarHBondContact O-CB 3.23Å; S546-L550 PolarHBondContact O-N 2.98Å
547	K	74.9	Confident	69.3	Low	106 Å²	106	99.3 Å²	99.3	46%	0.461	53%	0.532	S	S	.	.	H	α-helix	trans	-66.8	-41.9	174.7	-71.7	163.6	-163.1	169.6	0	112	E543 T544 L550 L551	E543-K547 WeakPolarHBondContact O-CB 3.41Å; E543-K547 VanDerWaalsContact O-CD 3.23Å; E543-K547 WeakPolarHBondContact O-CD 3.41Å; E543-K547 WeakPolarHBondContact O-CE 3.32Å; E543-K547 WeakPolarHBondContact O-CG 3.22Å; E543-K547 PolarHBondContact O-N 3.11Å; E543-K547 IonicContact OE2-NZ 3.83Å; E543-K547 PolarHBondContact OE2-NZ 3.26Å; T544-K547 PolarHBondContact O-N 3.03Å; K547-L550 PolarHBondContact O-N 2.97Å; K547-L551 WeakPolarHBondContact O-CG 3.31Å; K547-L551 PolarHBondContact O-N 3.29Å
548	E	79.7	Confident	71.1	Confident	142 Å²	142	102.1 Å²	102.1	66%	0.664	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-43.1	174.9	-71.5	-174.7	176.1	0	0	112.4	T544 L550 L551 A552	T544-E548 PolarHBondContact O-N 3.27Å; T544-E548 VanDerWaalsContact O-N 3.07Å; E548-L550 VanDerWaalsContact C-N 3.33Å; E548-L550 PolarHBondContact O-N 3.42Å; E548-L551 PolarHBondContact O-N 3.1Å; E548-A552 WeakPolarHBondContact O-CB 3.34Å; E548-A552 PolarHBondContact O-N 3.32Å
549	R	80.6	Confident	73	Confident	180 Å²	180	98.6 Å²	98.6	68%	0.679	52%	0.518	S	S	*	.	H	α-helix	trans	-62	-39.2	174	-69.9	177.6	-163	-160.2	8.7	112.2	E545 A552 A553	E545-R549 VanDerWaalsContact O-CG 3.29Å; E545-R549 WeakPolarHBondContact O-CG 3.29Å; E545-R549 PolarHBondContact O-N 3.12Å; E545-R549 VanDerWaalsContact O-N 3.13Å; E545-R549 IonicContact OE2-NH2 2.85Å; R549-A552 PolarHBondContact O-N 3.12Å; R549-A553 WeakPolarHBondContact O-CB 3.33Å; R549-A553 PolarHBondContact O-N 2.89Å
550	L	82.4	Confident	74.7	Confident	73 Å²	73	101.3 Å²	101.3	38%	0.382	52%	0.523	S	S	.	.	H	α-helix	trans	-64.9	-44.1	176.1	-179.1	62.8	0	0	0	111.8	S546 K547 E548 A553 L554	S546-L550 WeakPolarHBondContact O-CB 3.23Å; S546-L550 PolarHBondContact O-N 2.98Å; K547-L550 PolarHBondContact O-N 2.97Å; E548-L550 VanDerWaalsContact C-N 3.33Å; E548-L550 PolarHBondContact O-N 3.42Å; L550-A553 PolarHBondContact O-N 2.92Å; L550-L554 HydrophobicContact CD1-CD1 4.42Å; L550-L554 HydrophobicContact CD1-CG 4.46Å; L550-L554 HydrophobicContact CG-CD1 4.17Å; L550-L554 WeakPolarHBondContact O-CB 3.11Å; L550-L554 WeakPolarHBondContact O-CG 3.29Å; L550-L554 PolarHBondContact O-N 2.76Å
551	L	83.6	Confident	76.6	Confident	117 Å²	117	101.6 Å²	101.6	61%	0.613	52%	0.524	S	S	*	.	H	α-helix	trans	-62.5	-42.2	175.5	-72.2	170.2	0	0	0	111.9	K547 E548 L554 A555	K547-L551 WeakPolarHBondContact O-CG 3.31Å; K547-L551 PolarHBondContact O-N 3.29Å; E548-L551 PolarHBondContact O-N 3.1Å; L551-L554 PolarHBondContact O-N 3.37Å; L551-A555 WeakPolarHBondContact O-CB 3.46Å; L551-A555 PolarHBondContact O-N 2.89Å
552	A	82.9	Confident	78	Confident	52 Å²	52	100.7 Å²	100.7	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-42	174.8	0	0	0	0	0	112.3	E548 R549 A555 Q556	E548-A552 WeakPolarHBondContact O-CB 3.34Å; E548-A552 PolarHBondContact O-N 3.32Å; R549-A552 PolarHBondContact O-N 3.12Å; A552-A555 PolarHBondContact O-N 3.33Å; A552-Q556 WeakPolarHBondContact O-CG 3.34Å; A552-Q556 PolarHBondContact O-N 2.67Å
553	A	81.2	Confident	79.6	Confident	59 Å²	59	100.4 Å²	100.4	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-64.9	-42.3	176.3	0	0	0	0	0	112.3	R549 L550 Q556 G557	R549-A553 WeakPolarHBondContact O-CB 3.33Å; R549-A553 PolarHBondContact O-N 2.89Å; L550-A553 PolarHBondContact O-N 2.92Å; A553-Q556 PolarHBondContact O-N 3.42Å; A553-G557 PolarHBondContact O-N 3.36Å
554	L	80.5	Confident	81.1	Confident	98 Å²	98	103 Å²	103	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-44.5	174.9	-73.3	169.6	0	0	0	111.6	L550 L551 Q556 G557 L558	L550-L554 HydrophobicContact CD1-CD1 4.42Å; L550-L554 HydrophobicContact CD1-CG 4.46Å; L550-L554 HydrophobicContact CG-CD1 4.17Å; L550-L554 WeakPolarHBondContact O-CB 3.11Å; L550-L554 WeakPolarHBondContact O-CG 3.29Å; L550-L554 PolarHBondContact O-N 2.76Å; L551-L554 PolarHBondContact O-N 3.37Å; L554-Q556 PolarHBondContact O-N 2.96Å; L554-G557 PolarHBondContact O-N 3.41Å; L554-G557 VanDerWaalsContact O-N 3.16Å; L554-L558 WeakPolarHBondContact O-CG 3.43Å; L554-L558 PolarHBondContact O-N 3.14Å
555	A	83.8	Confident	82.4	Confident	48 Å²	48	101.8 Å²	101.8	40%	0.397	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-45.3	175.8	0	0	0	0	0	112	L551 A552 G557 L558 I559	L551-A555 WeakPolarHBondContact O-CB 3.46Å; L551-A555 PolarHBondContact O-N 2.89Å; A552-A555 PolarHBondContact O-N 3.33Å; A555-G557 VanDerWaalsContact C-N 3.33Å; A555-G557 PolarHBondContact O-N 3.31Å; A555-L558 PolarHBondContact O-N 2.86Å; A555-I559 VanDerWaalsContact O-CG1 3.29Å; A555-I559 WeakPolarHBondContact O-CG1 3.31Å; A555-I559 PolarHBondContact O-N 3.04Å
556	Q	84.9	Confident	83.7	Confident	117 Å²	117	101 Å²	101	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-63.3	-37.4	173.7	-72.1	-171.2	18.5	0	0	112.7	A552 A553 L554 I559 K560	A552-Q556 WeakPolarHBondContact O-CG 3.34Å; A552-Q556 PolarHBondContact O-N 2.67Å; A553-Q556 PolarHBondContact O-N 3.42Å; L554-Q556 PolarHBondContact O-N 2.96Å; Q556-I559 PolarHBondContact O-N 2.94Å; Q556-K560 WeakPolarHBondContact O-CB 3.42Å; Q556-K560 VanDerWaalsContact O-CG 3.29Å; Q556-K560 WeakPolarHBondContact O-CG 3.24Å; Q556-K560 PolarHBondContact O-N 3.3Å
557	G	81.8	Confident	84.4	Confident	30 Å²	30	103.4 Å²	103.4	31%	0.309	53%	0.525	S	S	.	.	H	α-helix	trans	-60.9	-48	174.7	0	0	0	0	0	112.2	A553 L554 A555 K560 L561	A553-G557 PolarHBondContact O-N 3.36Å; L554-G557 PolarHBondContact O-N 3.41Å; L554-G557 VanDerWaalsContact O-N 3.16Å; A555-G557 VanDerWaalsContact C-N 3.33Å; A555-G557 PolarHBondContact O-N 3.31Å; G557-K560 PolarHBondContact O-N 2.98Å; G557-L561 WeakPolarHBondContact O-CG 3.17Å; G557-L561 PolarHBondContact O-N 3.39Å
558	L	84.3	Confident	85.1	Confident	120 Å²	120	102.3 Å²	102.3	63%	0.628	52%	0.524	S	S	*	.	H	α-helix	trans	-62.5	-42.6	176.6	-69.5	169.9	0	0	0	112.1	L554 A555 K560 L561 H562	L554-L558 WeakPolarHBondContact O-CG 3.43Å; L554-L558 PolarHBondContact O-N 3.14Å; A555-L558 PolarHBondContact O-N 2.86Å; L558-K560 PolarHBondContact O-N 3.42Å; L558-L561 PolarHBondContact O-N 3.33Å; L558-H562 WeakPolarHBondContact O-CB 3.17Å; L558-H562 PolarHBondContact O-N 2.91Å
559	I	87.6	Confident	85.7	Confident	93 Å²	93	100.4 Å²	100.4	48%	0.477	52%	0.515	S	S	.	.	H	α-helix	trans	-63.2	-41.7	175.7	-67.7	164.2	0	0	0	111.2	A555 Q556 H562 R563	A555-I559 VanDerWaalsContact O-CG1 3.29Å; A555-I559 WeakPolarHBondContact O-CG1 3.31Å; A555-I559 PolarHBondContact O-N 3.04Å; Q556-I559 PolarHBondContact O-N 2.94Å; I559-H562 PolarHBondContact O-N 3.23Å; I559-R563 WeakPolarHBondContact O-CG 3.3Å; I559-R563 PolarHBondContact O-N 2.92Å
560	K	89	Confident	86.3	Confident	136 Å²	136	98.1 Å²	98.1	59%	0.591	51%	0.51	S	S	*	.	H	α-helix	trans	-64.6	-38.8	175.6	-75.5	170.1	179.9	172.2	0	112.2	Q556 G557 L558 K564	Q556-K560 WeakPolarHBondContact O-CB 3.42Å; Q556-K560 VanDerWaalsContact O-CG 3.29Å; Q556-K560 WeakPolarHBondContact O-CG 3.24Å; Q556-K560 PolarHBondContact O-N 3.3Å; G557-K560 PolarHBondContact O-N 2.98Å; L558-K560 PolarHBondContact O-N 3.42Å; K560-K564 PolarHBondContact O-N 2.88Å
561	L	86.4	Confident	86.7	Confident	119 Å²	119	97 Å²	97	62%	0.623	50%	0.504	S	S	*	.	H	α-helix	trans	-67.1	-43.9	174.5	-73.4	168.5	0	0	0	111.9	G557 L558 K564 A565	G557-L561 WeakPolarHBondContact O-CG 3.17Å; G557-L561 PolarHBondContact O-N 3.39Å; L558-L561 PolarHBondContact O-N 3.33Å; L561-K564 PolarHBondContact O-N 3.45Å; L561-A565 PolarHBondContact O-N 2.71Å
562	H	82.3	Confident	87.2	Confident	119 Å²	119	98.7 Å²	98.7	55%	0.551	51%	0.506	S	S	*	.	H	α-helix	trans	-65.4	-41.9	-179.5	-173.9	59.6	0	0	0	112.4	L558 I559 K564 A565 L566	L558-H562 WeakPolarHBondContact O-CB 3.17Å; L558-H562 PolarHBondContact O-N 2.91Å; I559-H562 PolarHBondContact O-N 3.23Å; H562-K564 PolarHBondContact O-N 2.87Å; H562-A565 WeakPolarHBondContact O-CB 3.34Å; H562-A565 PolarHBondContact O-N 2.81Å; H562-A565 VanDerWaalsContact O-N 3.16Å; H562-L566 PolarHBondContact O-N 3.41Å
563	R	89.1	Confident	87.6	Confident	168 Å²	168	100.8 Å²	100.8	63%	0.634	51%	0.507	S	S	*	.	H	α-helix	trans	-57.6	-46.2	172.6	-73	-178.2	-178.4	-167.7	0.2	112	I559 A565 L566 E567	I559-R563 WeakPolarHBondContact O-CG 3.3Å; I559-R563 PolarHBondContact O-N 2.92Å; R563-A565 VanDerWaalsContact C-N 3.31Å; R563-A565 PolarHBondContact O-N 2.89Å; R563-L566 PolarHBondContact O-N 3.37Å; R563-E567 WeakPolarHBondContact O-CG 3.32Å; R563-E567 PolarHBondContact O-N 2.63Å
564	K	89.6	Confident	88.2	Confident	136 Å²	136	101.9 Å²	101.9	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-63.7	-33.2	175.8	-73.9	-173.9	174.3	-171	0	113.3	K560 L561 H562 L568	K560-K564 PolarHBondContact O-N 2.88Å; L561-K564 PolarHBondContact O-N 3.45Å; H562-K564 PolarHBondContact O-N 2.87Å; K564-L568 WeakPolarHBondContact O-CB 3.31Å; K564-L568 VanDerWaalsContact O-CG 3.27Å; K564-L568 WeakPolarHBondContact O-CG 3.43Å; K564-L568 PolarHBondContact O-N 2.85Å
565	A	87.8	Confident	88.7	Confident	53 Å²	53	103.6 Å²	103.6	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-65.4	-44	174.7	0	0	0	0	0	111.7	L561 H562 R563 L568 E569	L561-A565 PolarHBondContact O-N 2.71Å; H562-A565 WeakPolarHBondContact O-CB 3.34Å; H562-A565 PolarHBondContact O-N 2.81Å; H562-A565 VanDerWaalsContact O-N 3.16Å; R563-A565 VanDerWaalsContact C-N 3.31Å; R563-A565 PolarHBondContact O-N 2.89Å; A565-L568 PolarHBondContact O-N 3.21Å; A565-E569 PolarHBondContact O-N 3.09Å
566	L	89.9	Confident	89.1	Confident	91 Å²	91	106.7 Å²	106.7	48%	0.476	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-39.7	176	-65.9	171.1	0	0	0	112.3	H562 R563 E569 K570	H562-L566 PolarHBondContact O-N 3.41Å; R563-L566 PolarHBondContact O-N 3.37Å; L566-E569 PolarHBondContact O-N 3.38Å; L566-K570 PolarHBondContact O-N 2.81Å
567	E	90.2	Very high	89.5	Confident	115 Å²	115	106.3 Å²	106.3	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-59.9	-45.5	172.4	-73.1	166.9	-163.9	0	0	111.8	R563 K570 I571	R563-E567 WeakPolarHBondContact O-CG 3.32Å; R563-E567 PolarHBondContact O-N 2.63Å; E567-K570 PolarHBondContact O-N 2.75Å; E567-I571 WeakPolarHBondContact O-CD1 3.5Å; E567-I571 VanDerWaalsContact O-CG1 3.25Å; E567-I571 WeakPolarHBondContact O-CG1 3.45Å; E567-I571 PolarHBondContact O-N 3.06Å
568	L	90.3	Very high	90.1	Very high	82 Å²	82	110 Å²	110	43%	0.429	53%	0.525	S	S	.	.	H	α-helix	trans	-65.3	-36.9	177.1	-73.7	169.8	0	0	0	112.6	K564 A565 K572	K564-L568 WeakPolarHBondContact O-CB 3.31Å; K564-L568 VanDerWaalsContact O-CG 3.27Å; K564-L568 WeakPolarHBondContact O-CG 3.43Å; K564-L568 PolarHBondContact O-N 2.85Å; A565-L568 PolarHBondContact O-N 3.21Å; L568-K572 WeakPolarHBondContact O-CB 3.44Å; L568-K572 PolarHBondContact O-N 3.33Å
569	E	91.1	Very high	90.5	Very high	103 Å²	103	110.5 Å²	110.5	48%	0.481	53%	0.525	S	S	.	.	H	α-helix	trans	-65.9	-44.4	174.3	179.4	159.6	-148.7	0	0	111.9	A565 L566 I571 K572 Q573	A565-E569 PolarHBondContact O-N 3.09Å; L566-E569 PolarHBondContact O-N 3.38Å; E569-I571 PolarHBondContact O-N 2.89Å; E569-K572 WeakPolarHBondContact O-CB 3.49Å; E569-K572 PolarHBondContact O-N 2.77Å; E569-K572 VanDerWaalsContact O-N 3.15Å; E569-Q573 WeakPolarHBondContact O-CG 3.41Å; E569-Q573 PolarHBondContact O-N 3.32Å
570	K	93.7	Very high	90.6	Very high	131 Å²	131	111.1 Å²	111.1	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-57.8	-48	174.1	-176.6	175.9	174.9	-179.8	0	111.6	L566 E567 K572 Q573 E574	L566-K570 PolarHBondContact O-N 2.81Å; E567-K570 PolarHBondContact O-N 2.75Å; K570-K572 VanDerWaalsContact C-N 3.27Å; K570-K572 PolarHBondContact O-N 3.37Å; K570-Q573 PolarHBondContact O-N 3.43Å; K570-Q573 VanDerWaalsContact O-N 3.11Å; K570-E574 WeakPolarHBondContact CE-OE1 3.31Å; K570-E574 WeakPolarHBondContact O-CG 3.37Å; K570-E574 PolarHBondContact O-N 3.31Å
571	I	91.2	Very high	90.6	Very high	50 Å²	50	109.5 Å²	109.5	26%	0.256	52%	0.521	S	S	.	.	H	α-helix	trans	-59.6	-37	177	-68.2	158.7	0	0	0	111.7	E567 E569 Q575	E567-I571 WeakPolarHBondContact O-CD1 3.5Å; E567-I571 VanDerWaalsContact O-CG1 3.25Å; E567-I571 WeakPolarHBondContact O-CG1 3.45Å; E567-I571 PolarHBondContact O-N 3.06Å; E569-I571 PolarHBondContact O-N 2.89Å; I571-Q575 WeakPolarHBondContact O-CB 3.22Å; I571-Q575 WeakPolarHBondContact O-CG 3.26Å; I571-Q575 PolarHBondContact O-N 2.87Å
572	K	93.7	Very high	90.9	Very high	153 Å²	153	110.3 Å²	110.3	67%	0.665	52%	0.52	S	S	*	.	H	α-helix	trans	-67.4	-39.9	175.9	-179.2	-171.8	172.2	-165.5	0	111.9	L568 E569 K570 M576	L568-K572 WeakPolarHBondContact O-CB 3.44Å; L568-K572 PolarHBondContact O-N 3.33Å; E569-K572 WeakPolarHBondContact O-CB 3.49Å; E569-K572 PolarHBondContact O-N 2.77Å; E569-K572 VanDerWaalsContact O-N 3.15Å; K570-K572 VanDerWaalsContact C-N 3.27Å; K570-K572 PolarHBondContact O-N 3.37Å; K572-M576 WeakPolarHBondContact O-CB 3.42Å; K572-M576 PolarHBondContact O-N 2.91Å
573	Q	91.7	Very high	90.8	Very high	95 Å²	95	110 Å²	110	44%	0.444	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-43.6	174.5	-67.2	178.1	12.9	0	0	111.4	E569 K570 M576 Q577	E569-Q573 WeakPolarHBondContact O-CG 3.41Å; E569-Q573 PolarHBondContact O-N 3.32Å; K570-Q573 PolarHBondContact O-N 3.43Å; K570-Q573 VanDerWaalsContact O-N 3.11Å; Q573-M576 WeakPolarHBondContact O-CB 3.14Å; Q573-M576 PolarHBondContact O-N 2.95Å; Q573-Q577 WeakPolarHBondContact O-CG 3.22Å; Q573-Q577 PolarHBondContact O-N 3.16Å
574	E	92.8	Very high	90.5	Very high	83 Å²	83	106.6 Å²	106.6	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-60.4	-46	174.5	-71.2	169.4	177.4	0	0	112	K570 M576 Q577 L578	K570-E574 WeakPolarHBondContact CE-OE1 3.31Å; K570-E574 WeakPolarHBondContact O-CG 3.37Å; K570-E574 PolarHBondContact O-N 3.31Å; E574-M576 VanDerWaalsContact C-N 3.32Å; E574-M576 PolarHBondContact O-N 3.19Å; E574-Q577 PolarHBondContact O-N 2.86Å; E574-L578 WeakPolarHBondContact O-CB 3.46Å; E574-L578 WeakPolarHBondContact O-CG 3.37Å; E574-L578 PolarHBondContact O-N 3.27Å
575	Q	92.6	Very high	90.2	Very high	134 Å²	134	106.1 Å²	106.1	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-61.3	-39	174.6	-79.4	-167.7	-5.6	0	0	112.6	I571 Q579	I571-Q575 WeakPolarHBondContact O-CB 3.22Å; I571-Q575 WeakPolarHBondContact O-CG 3.26Å; I571-Q575 PolarHBondContact O-N 2.87Å; Q575-Q579 WeakPolarHBondContact O-CB 3.46Å; Q575-Q579 PolarHBondContact O-N 3.35Å
576	M	91.7	Very high	89.7	Confident	113 Å²	113	110.8 Å²	110.8	56%	0.557	52%	0.522	S	S	*	.	H	α-helix	trans	-65.8	-44.2	176.8	-177	173.9	64.9	0	0	111.6	K572 Q573 E574 Q579 M580	K572-M576 WeakPolarHBondContact O-CB 3.42Å; K572-M576 PolarHBondContact O-N 2.91Å; Q573-M576 WeakPolarHBondContact O-CB 3.14Å; Q573-M576 PolarHBondContact O-N 2.95Å; E574-M576 VanDerWaalsContact C-N 3.32Å; E574-M576 PolarHBondContact O-N 3.19Å; M576-Q579 PolarHBondContact O-N 2.95Å; M576-M580 WeakPolarHBondContact O-CG 3.39Å; M576-M580 PolarHBondContact O-N 3.05Å
577	Q	94	Very high	88.2	Confident	109 Å²	109	111.9 Å²	111.9	51%	0.509	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-46.9	174.7	-72.2	177.9	-1.4	0	0	111.7	Q573 E574 Q579 M580 Q581	Q573-Q577 WeakPolarHBondContact O-CG 3.22Å; Q573-Q577 PolarHBondContact O-N 3.16Å; E574-Q577 PolarHBondContact O-N 2.86Å; Q577-Q579 VanDerWaalsContact C-N 3.26Å; Q577-Q579 PolarHBondContact O-N 3.3Å; Q577-M580 PolarHBondContact O-N 3.39Å; Q577-M580 VanDerWaalsContact O-N 3.12Å; Q577-Q581 WeakPolarHBondContact O-CG 3.48Å; Q577-Q581 PolarHBondContact O-N 2.97Å
578	L	93.8	Very high	86.5	Confident	107 Å²	107	113.9 Å²	113.9	56%	0.56	55%	0.545	S	S	*	.	H	α-helix	trans	-60	-35.2	174.1	-73.7	168.5	0	0	0	112.2	E574 K582	E574-L578 WeakPolarHBondContact O-CB 3.46Å; E574-L578 WeakPolarHBondContact O-CG 3.37Å; E574-L578 PolarHBondContact O-N 3.27Å; L578-K582 WeakPolarHBondContact O-CB 2.97Å; L578-K582 PolarHBondContact O-N 2.77Å
579	Q	92.7	Very high	84.3	Confident	131 Å²	131	114.8 Å²	114.8	61%	0.612	55%	0.554	S	S	*	*	H	α-helix	trans	-68.7	-40.4	174.3	-174	174.5	-0.5	0	0	111.8	Q575 M576 Q577 K582 M583	Q575-Q579 WeakPolarHBondContact O-CB 3.46Å; Q575-Q579 PolarHBondContact O-N 3.35Å; M576-Q579 PolarHBondContact O-N 2.95Å; Q577-Q579 VanDerWaalsContact C-N 3.26Å; Q577-Q579 PolarHBondContact O-N 3.3Å; Q579-K582 PolarHBondContact O-N 3.05Å; Q579-M583 WeakPolarHBondContact O-CG 3.38Å; Q579-M583 PolarHBondContact O-N 3.43Å
580	M	88.5	Confident	82.1	Confident	106 Å²	106	114.6 Å²	114.6	52%	0.522	56%	0.562	S	S	.	*	H	α-helix	trans	-64	-49.5	174.3	-65.2	-155.4	-50.4	0	0	111.6	M576 Q577 K582 M583 Q584	M576-M580 WeakPolarHBondContact O-CG 3.39Å; M576-M580 PolarHBondContact O-N 3.05Å; Q577-M580 PolarHBondContact O-N 3.39Å; Q577-M580 VanDerWaalsContact O-N 3.12Å; M580-K582 VanDerWaalsContact C-N 3.26Å; M580-K582 PolarHBondContact O-N 3.25Å; M580-M583 CarbonylContact O-C 3.58Å; M580-M583 WeakPolarHBondContact O-CA 3.4Å; M580-M583 WeakPolarHBondContact O-CB 3.34Å; M580-M583 PolarHBondContact O-N 2.84Å; M580-Q584 PolarHBondContact O-N 2.96Å
581	Q	90.7	Very high	79.8	Confident	101 Å²	101	118.5 Å²	118.5	47%	0.472	58%	0.578	S	S	.	*	H	α-helix	trans	-56.2	-41.6	175.1	-72.6	179.7	-9.3	0	0	111.6	Q577 M583 Q584 Q585	Q577-Q581 WeakPolarHBondContact O-CG 3.48Å; Q577-Q581 PolarHBondContact O-N 2.97Å; Q581-M583 VanDerWaalsContact C-N 3.26Å; Q581-M583 PolarHBondContact O-N 2.68Å; Q581-Q584 PolarHBondContact O-N 3.44Å; Q581-Q585 WeakPolarHBondContact O-CB 3.48Å; Q581-Q585 WeakPolarHBondContact O-CG 3.41Å; Q581-Q585 PolarHBondContact O-N 3.49Å
582	K	91.2	Very high	77.2	Confident	136 Å²	136	121.2 Å²	121.2	59%	0.591	60%	0.602	S	S	*	*	H	α-helix	trans	-70.5	-17.1	175.9	-168	168.1	-170.8	167.1	0	113.9	L578 Q579 M580 K586	L578-K582 WeakPolarHBondContact O-CB 2.97Å; L578-K582 PolarHBondContact O-N 2.77Å; Q579-K582 PolarHBondContact O-N 3.05Å; M580-K582 VanDerWaalsContact C-N 3.26Å; M580-K582 PolarHBondContact O-N 3.25Å; K582-K586 WeakPolarHBondContact O-CB 3.36Å; K582-K586 WeakPolarHBondContact O-CD 3.36Å; K582-K586 VanDerWaalsContact O-CG 3.23Å; K582-K586 WeakPolarHBondContact O-CG 3.41Å
583	M	81.4	Confident	74.4	Confident	112 Å²	112	117.3 Å²	117.3	55%	0.552	61%	0.605	S	S	*	*	H	α-helix	trans	-84.4	-42.9	166.9	-69.2	-158.1	-58.2	0	0	111.6	Q579 M580 Q581 K586 C587	Q579-M583 WeakPolarHBondContact O-CG 3.38Å; Q579-M583 PolarHBondContact O-N 3.43Å; M580-M583 CarbonylContact O-C 3.58Å; M580-M583 WeakPolarHBondContact O-CA 3.4Å; M580-M583 WeakPolarHBondContact O-CB 3.34Å; M580-M583 PolarHBondContact O-N 2.84Å; Q581-M583 VanDerWaalsContact C-N 3.26Å; Q581-M583 PolarHBondContact O-N 2.68Å; M583-K586 WeakPolarHBondContact O-CB 3.39Å; M583-K586 PolarHBondContact O-N 3.13Å; M583-K586 VanDerWaalsContact O-N 3.16Å; M583-C587 PolarHBondContact O-N 3.04Å; M583-C587 PolarHBondContact O-SG 3.13Å
584	Q	81.6	Confident	71.5	Confident	98 Å²	98	117.7 Å²	117.7	46%	0.458	62%	0.618	S	S	.	*	H	α-helix	trans	-55.7	-54.4	173.8	-70.6	166.5	-60.2	0	0	110.7	M580 Q581 K586 C587 E588	M580-Q584 PolarHBondContact O-N 2.96Å; Q581-Q584 PolarHBondContact O-N 3.44Å; Q584-K586 VanDerWaalsContact C-N 3.26Å; Q584-K586 PolarHBondContact O-N 3.19Å; Q584-C587 WeakPolarHBondContact O-CA 3.43Å; Q584-C587 WeakPolarHBondContact O-CB 3.45Å; Q584-C587 PolarHBondContact O-N 3.15Å; Q584-E588 PolarHBondContact O-N 2.97Å
585	Q	83	Confident	68.9	Low	125 Å²	125	120 Å²	120	58%	0.584	64%	0.64	S	S	*	*	H	α-helix	trans	-57.2	-34.6	176	-71.2	176.4	-2.8	0	0	113.4	Q581 C587 E588 T589	Q581-Q585 WeakPolarHBondContact O-CB 3.48Å; Q581-Q585 WeakPolarHBondContact O-CG 3.41Å; Q581-Q585 PolarHBondContact O-N 3.49Å; Q585-C587 VanDerWaalsContact C-N 3.34Å; Q585-E588 PolarHBondContact O-N 2.98Å; Q585-T589 PolarHBondContact O-N 3.47Å; Q585-T589 PolarHBondContact O-OG1 2.84Å
586	K	78.3	Confident	66	Low	152 Å²	152	116.7 Å²	116.7	66%	0.661	64%	0.642	S	S	*	*	H	α-helix	trans	-71.6	-26.5	175.6	-85.1	179.1	177.2	-177.3	0	113.7	K582 M583 Q584	K582-K586 WeakPolarHBondContact O-CB 3.36Å; K582-K586 WeakPolarHBondContact O-CD 3.36Å; K582-K586 VanDerWaalsContact O-CG 3.23Å; K582-K586 WeakPolarHBondContact O-CG 3.41Å; M583-K586 WeakPolarHBondContact O-CB 3.39Å; M583-K586 PolarHBondContact O-N 3.13Å; M583-K586 VanDerWaalsContact O-N 3.16Å; Q584-K586 VanDerWaalsContact C-N 3.26Å; Q584-K586 PolarHBondContact O-N 3.19Å
587	C	58.7	Low	63.5	Low	113 Å²	113	120.9 Å²	120.9	76%	0.764	66%	0.657	S	S	*	*	H	α-helix	trans	-78	-31.2	170.7	-67.1	0	0	0	0	111.4	M583 Q584 Q585	M583-C587 PolarHBondContact O-N 3.04Å; M583-C587 PolarHBondContact O-SG 3.13Å; Q584-C587 WeakPolarHBondContact O-CA 3.43Å; Q584-C587 WeakPolarHBondContact O-CB 3.45Å; Q584-C587 PolarHBondContact O-N 3.15Å; Q585-C587 VanDerWaalsContact C-N 3.34Å
588	E	53.9	Low	60.7	Low	158 Å²	158	122.3 Å²	122.3	74%	0.738	67%	0.672	S	S	*	*	H	α-helix	trans	-95.1	-4.7	-175.3	-66.1	-166.6	154.2	0	0	115.7	Q584 Q585 P590	Q584-E588 PolarHBondContact O-N 2.97Å; Q585-E588 PolarHBondContact O-N 2.98Å; E588-P590 WeakPolarHBondContact O-CD 3.46Å
589	T	44.4	Very low	57.9	Low	101 Å²	101	122.3 Å²	122.3	62%	0.62	69%	0.688	S	S	*	*	S	Bend	trans	-83.4	93.5	160.5	53.9	0	0	0	0	109.8	Q585	Q585-T589 PolarHBondContact O-N 3.47Å; Q585-T589 PolarHBondContact O-OG1 2.84Å
590	P	45.5	Very low	55.4	Low	99 Å²	99	124 Å²	124	64%	0.643	70%	0.696	S	S	*	*			trans	-61.8	143.4	168.6	29.3	-36.3	0	0	0	108.7	E588 S592	E588-P590 WeakPolarHBondContact O-CD 3.46Å; P590-S592 PolarHBondContact O-N 3.26Å
591	K	45.4	Very low	53.1	Low	213 Å²	213	127.6 Å²	127.6	93%	0.926	71%	0.709	S	S	*	*			trans	-73.4	79.1	163.4	-76.3	-174.6	175.3	-179.7	0	109.1	G593	K591-G593 PolarHBondContact O-N 3.32Å
592	S	35.5	Very low	50.7	Low	107 Å²	107	131.4 Å²	131.4	75%	0.748	73%	0.726	S	S	*	*			trans	-68.8	48.7	162.1	46.9	0	0	0	0	111.2	P590 S594	P590-S592 PolarHBondContact O-N 3.26Å; S592-S594 PolarHBondContact O-N 2.81Å
593	G	35.3	Very low	48.3	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	74%	0.739	S	S	*	*			trans	-63.2	106.6	162.4	0	0	0	0	0	107.6	K591	K591-G593 PolarHBondContact O-N 3.32Å
594	S	30.8	Very low	46.8	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	76%	0.755	S	S	*	*			trans	-46.6	145.5	-173.6	-178.1	0	0	0	0	113.1	S592 G596	S592-S594 PolarHBondContact O-N 2.81Å; S594-G596 PolarHBondContact O-N 2.85Å
595	P	37.6	Very low	45.6	Very low	133 Å²	133	140 Å²	140	86%	0.864	77%	0.769	S	S	*	*			trans	-67.2	70	-178.8	28.1	-36.6	0	0	0	113.9	K597	P595-K597 PolarHBondContact O-N 3.06Å; P595-K597 VanDerWaalsContact O-N 3.09Å
596	G	31.9	Very low	44.1	Very low	63 Å²	63	140.5 Å²	140.5	65%	0.649	78%	0.776	S	S	*	*			trans	-80.4	79.2	-179	0	0	0	0	0	114.2	S594	S594-G596 PolarHBondContact O-N 2.85Å
597	K	40.4	Very low	43	Very low	202 Å²	202	136.9 Å²	136.9	88%	0.878	76%	0.764	S	S	*	*	S	Bend	trans	52.9	60.9	154.3	-58	-175.7	177.3	-178.4	0	118.7	P595	P595-K597 PolarHBondContact O-N 3.06Å; P595-K597 VanDerWaalsContact O-N 3.09Å
598	V	34.4	Very low	43	Very low	138 Å²	138	134.7 Å²	134.7	84%	0.836	75%	0.754	S	S	*	*			trans	-138.4	45.4	149.1	-157.1	0	0	0	0	112.1	E600	V598-E600 PolarHBondContact O-N 3.14Å; V598-E600 VanDerWaalsContact O-N 3.15Å
599	A	34.4	Very low	43.5	Very low	108 Å²	108	132.1 Å²	132.1	89%	0.893	75%	0.749	S	S	*	*			trans	-84.5	41.3	176.2	0	0	0	0	0	113
600	E	40.1	Very low	44.2	Very low	166 Å²	166	134.2 Å²	134.2	78%	0.776	75%	0.749	S	S	*	*			trans	-154.9	68.1	174.5	-149.1	-178.6	-150.8	0	0	115.1	V598	V598-E600 PolarHBondContact O-N 3.14Å; V598-E600 VanDerWaalsContact O-N 3.15Å
601	K	41.2	Very low	44.6	Very low	181 Å²	181	138 Å²	138	79%	0.787	75%	0.751	S	S	*	*	S	Bend	trans	-168.5	148.8	146.1	-99.5	133.5	-161.9	153.7	0	110.4
602	H	39.4	Very low	45.3	Very low	181 Å²	181	134.5 Å²	134.5	84%	0.838	74%	0.741	S	S	*	*	S	Bend	trans	82.1	21.1	173.2	-49.4	-64.7	0	0	0	120.4
603	Q	41.8	Very low	46.4	Very low	185 Å²	185	132.5 Å²	132.5	86%	0.864	73%	0.731	S	S	*	*			trans	-92.7	5.1	157.7	-104.4	-177.5	-3.1	0	0	114.3	K605	Q603-K605 VanDerWaalsContact C-N 3.27Å; Q603-K605 PolarHBondContact O-N 2.83Å
604	L	50	Low	47.4	Very low	170 Å²	170	134.9 Å²	134.9	89%	0.89	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	50.3	-179	-82	169.1	0	0	0	114.3
605	K	55.6	Low	48.3	Very low	172 Å²	172	133.6 Å²	133.6	75%	0.748	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.4	-42.4	171.2	-73.7	-156.7	174.7	-165	0	116.3	Q603	Q603-K605 VanDerWaalsContact C-N 3.27Å; Q603-K605 PolarHBondContact O-N 2.83Å
606	D	52.3	Low	48.6	Very low	136 Å²	136	134.3 Å²	134.3	73%	0.727	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-30.9	-174.8	-57.1	-37	0	0	0	112.9	A608 V609 K610	D606-A608 VanDerWaalsContact C-N 3.26Å; D606-A608 PolarHBondContact O-N 3.01Å; D606-V609 WeakPolarHBondContact O-CB 3.5Å; D606-V609 PolarHBondContact O-N 3.04Å; D606-K610 PolarHBondContact O-N 2.71Å
607	D	55.2	Low	49.1	Very low	76 Å²	76	138.8 Å²	138.8	41%	0.406	72%	0.723	S	S	.	*	H	α-helix	trans	-70.1	-22.7	-177.2	-154.2	59.9	0	0	0	113.2	V609 R611	D607-V609 VanDerWaalsContact C-N 3.31Å; D607-R611 VanDerWaalsContact O-CG 3.27Å; D607-R611 WeakPolarHBondContact O-CG 3.47Å; D607-R611 PolarHBondContact O-N 3.38Å; D607-R611 VanDerWaalsContact O-N 3.15Å; D607-R611 IonicContact OD2-CZ 3.2Å; D607-R611 IonicContact OD2-NE 2.69Å; D607-R611 PolarHBondContact OD2-NE 3.24Å; D607-R611 IonicContact OD2-NH2 2.64Å; D607-R611 PolarHBondContact OD2-NH2 2.89Å
608	A	58.1	Low	49.2	Very low	67 Å²	67	137.1 Å²	137.1	55%	0.554	72%	0.723	S	S	*	*	H	α-helix	trans	-67.5	-31.1	170.5	0	0	0	0	0	112.4	D606 L612	D606-A608 VanDerWaalsContact C-N 3.26Å; D606-A608 PolarHBondContact O-N 3.01Å; A608-L612 PolarHBondContact O-N 2.96Å
609	V	63.5	Low	49.4	Very low	104 Å²	104	139.5 Å²	139.5	63%	0.63	72%	0.722	S	S	*	*	H	α-helix	trans	-74.9	-40.5	178.8	-175.6	0	0	0	0	110.5	D606 D607 L612 A613	D606-V609 WeakPolarHBondContact O-CB 3.5Å; D606-V609 PolarHBondContact O-N 3.04Å; D607-V609 VanDerWaalsContact C-N 3.31Å; V609-L612 PolarHBondContact O-N 2.91Å; V609-A613 PolarHBondContact O-N 3.29Å
610	K	59.3	Low	49.8	Very low	144 Å²	144	140.8 Å²	140.8	63%	0.626	72%	0.721	S	S	*	*	H	α-helix	trans	-58.6	-51.8	171.9	-95.8	-169.6	168.8	-170.4	0	112.1	D606 L612 A613 D614	D606-K610 PolarHBondContact O-N 2.71Å; K610-L612 PolarHBondContact O-N 2.87Å; K610-L612 VanDerWaalsContact O-N 3.13Å; K610-A613 WeakPolarHBondContact O-CB 3.39Å; K610-A613 PolarHBondContact O-N 3.47Å; K610-D614 PolarHBondContact O-N 2.9Å
611	R	55.4	Low	49.7	Very low	180 Å²	180	142.3 Å²	142.3	68%	0.679	73%	0.726	S	S	*	*	H	α-helix	trans	-60.9	-24.4	-179.6	-66.8	172.8	-162.6	-144.2	5.5	113.6	D607	D607-R611 VanDerWaalsContact O-CG 3.27Å; D607-R611 WeakPolarHBondContact O-CG 3.47Å; D607-R611 PolarHBondContact O-N 3.38Å; D607-R611 VanDerWaalsContact O-N 3.15Å; D607-R611 IonicContact OD2-CZ 3.2Å; D607-R611 IonicContact OD2-NE 2.69Å; D607-R611 PolarHBondContact OD2-NE 3.24Å; D607-R611 IonicContact OD2-NH2 2.64Å; D607-R611 PolarHBondContact OD2-NH2 2.89Å
612	L	58.7	Low	49.7	Very low	139 Å²	139	142.1 Å²	142.1	73%	0.728	73%	0.73	S	S	*	*	H	α-helix	trans	-81.4	-24.9	174.6	-153.6	77.7	0	0	0	113.2	A608 V609 K610	A608-L612 PolarHBondContact O-N 2.96Å; V609-L612 PolarHBondContact O-N 2.91Å; K610-L612 PolarHBondContact O-N 2.87Å; K610-L612 VanDerWaalsContact O-N 3.13Å
613	A	60	Low	49.5	Very low	64 Å²	64	142.9 Å²	142.9	53%	0.529	73%	0.73	S	S	.	*	H	α-helix	trans	-76.6	-46.5	176.6	0	0	0	0	0	111.8	V609 K610 A615	V609-A613 PolarHBondContact O-N 3.29Å; K610-A613 WeakPolarHBondContact O-CB 3.39Å; K610-A613 PolarHBondContact O-N 3.47Å; A613-A615 VanDerWaalsContact C-N 3.3Å; A613-A615 PolarHBondContact O-N 3.35Å
614	D	54.9	Low	49	Very low	120 Å²	120	139 Å²	139	64%	0.642	73%	0.73	S	S	*	*	H	α-helix	trans	-74.3	-18.6	-172.8	-61.7	-36.1	0	0	0	113.4	K610 N616	K610-D614 PolarHBondContact O-N 2.9Å; D614-N616 VanDerWaalsContact C-N 3.27Å; D614-N616 PolarHBondContact O-N 3.11Å
615	A	50.6	Low	48.3	Very low	77 Å²	77	139.9 Å²	139.9	64%	0.636	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-14.2	-178.4	0	0	0	0	0	115.1	A613	A613-A615 VanDerWaalsContact C-N 3.3Å; A613-A615 PolarHBondContact O-N 3.35Å
616	N	44.5	Very low	47.1	Very low	148 Å²	148	141 Å²	141	79%	0.791	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	9.9	-174.4	-84.9	-40.9	0	0	0	115	D614	D614-N616 VanDerWaalsContact C-N 3.27Å; D614-N616 PolarHBondContact O-N 3.11Å
617	Q	41.9	Very low	46	Very low	156 Å²	156	143.7 Å²	143.7	73%	0.729	74%	0.743	S	S	*	*			trans	-97.7	-5.4	-172.8	-74.2	-81.7	19	0	0	115.7
618	L	41.4	Very low	44.8	Very low	168 Å²	168	146.4 Å²	146.4	88%	0.88	76%	0.763	S	S	*	*			trans	-106.1	101	179.7	-73.4	174.6	0	0	0	112.4
619	K	39	Very low	43.6	Very low	187 Å²	187	148.9 Å²	148.9	81%	0.813	78%	0.776	S	S	*	*			trans	-79.3	126.6	178.3	-62	173.7	-178.1	173.6	0	111.1	K621	K619-K621 PolarHBondContact O-N 3.12Å
620	P	42.1	Very low	42.3	Very low	135 Å²	135	151.2 Å²	151.2	88%	0.877	78%	0.784	S	S	*	*			trans	-63.2	124	170.1	-22.2	34.1	0	0	0	111.7
621	K	38.3	Very low	41.1	Very low	198 Å²	198	149.8 Å²	149.8	86%	0.861	79%	0.793	S	S	*	*			trans	-114	110.5	165.8	-77.3	-178.2	178.9	175.4	0	108.8	K619	K619-K621 PolarHBondContact O-N 3.12Å
622	M	41	Very low	40.3	Very low	177 Å²	177	146.2 Å²	146.2	87%	0.872	80%	0.802	S	S	*	*			trans	178.1	107.2	144.4	-98.1	174.2	83.8	0	0	105.6
623	K	35.1	Very low	39.2	Very low	197 Å²	197	149.9 Å²	149.9	86%	0.857	81%	0.812	S	S	*	*				77.9	107.6	75.3	-87.5	-159.9	170.3	-170.9	0	113
624	A	33	Very low	37.9	Very low	104 Å²	104	150.6 Å²	150.6	86%	0.86	83%	0.825	S	S	*	*			trans	56.9	105.4	149	0	0	0	0	0	118.8
625	E	33.5	Very low	36.7	Very low	189 Å²	189	155.8 Å²	155.8	88%	0.883	84%	0.836	S	S	*	*				-137.8	154.2	114.9	-164.8	151.2	-146.8	0	0	109.6
626	K	31.1	Very low	35.9	Very low	195 Å²	195	159.7 Å²	159.7	85%	0.848	84%	0.841	S	S	*	*			trans	-94	123.8	177.2	-69.2	178.6	179.5	177.8	0	109.2
627	Q	30.1	Very low	35.2	Very low	192 Å²	192	160.4 Å²	160.4	90%	0.897	84%	0.839	S	S	*	*			trans	-132.9	125.6	152	-72	-165	-9.5	0	0	109.8
628	T	28.7	Very low	34.7	Very low	134 Å²	134	162.3 Å²	162.3	82%	0.822	84%	0.839	S	S	*	*			trans	-101	128.4	-179.8	44.8	0	0	0	0	109.9
629	S	34.6	Very low	34.4	Very low	119 Å²	119	161.2 Å²	161.2	83%	0.832	83%	0.83	S	S	*	*			trans	-162.1	129.4	155.8	34.8	0	0	0	0	109.5
630	D	34.3	Very low	34	Very low	152 Å²	152	160.7 Å²	160.7	81%	0.813	83%	0.83	S	S	*	*			trans	-84.3	154.1	-171.9	-72	-73.8	0	0	0	113.7
631	S	34.5	Very low	34.1	Very low	114 Å²	114	159.6 Å²	159.6	80%	0.797	83%	0.825	S	S	*	*			trans	36	112.5	149.7	64.3	0	0	0	0	120
632	A	39.2	Very low	34.3	Very low	105 Å²	105	155.2 Å²	155.2	87%	0.868	82%	0.817	S	S	*	*				-163.5	152.5	122.7	0	0	0	0	0	113.7
633	K	36.4	Very low	33.8	Very low	217 Å²	217	156 Å²	156	94%	0.943	82%	0.816	S	S	*	*			trans	-69.5	123.3	177.3	-59.2	152.7	-178	168.9	0	110.3
634	G	30.9	Very low	33.8	Very low	79 Å²	79	153 Å²	153	81%	0.814	81%	0.814	S	S	*	*			trans	-135.3	113.5	-179.5	0	0	0	0	0	113.7
635	R	30.8	Very low	33.7	Very low	229 Å²	229	152.6 Å²	152.6	86%	0.864	81%	0.805	S	S	*	*			trans	-80.2	147.1	-177.9	-87.6	178.1	167.3	-164.7	-1.3	113.5
636	H	33.5	Very low	33.7	Very low	159 Å²	159	149.6 Å²	149.6	74%	0.736	81%	0.805	S	S	*	*			trans	44.9	129.5	146.6	-64.1	-70.8	0	0	0	122.1
637	H	30.3	Very low	33.7	Very low	163 Å²	163	143.8 Å²	143.8	76%	0.755	80%	0.801	S	S	*	*			trans	95.1	134.5	131.6	-95.6	-2.7	0	0	0	122.5
638	R	31.2	Very low	33.8	Very low	195 Å²	195	138.2 Å²	138.2	74%	0.736	80%	0.795	S	S	*	*			trans	77.2	98.7	146.7	-71.7	-172.9	179.6	-164	0.4	121.8
639	Q	34.3	Very low	34.2	Very low	146 Å²	146	141.9 Å²	141.9	68%	0.682	80%	0.8	S	S	*	*				82.5	156.3	115.3	-74	-180	-47.5	0	0	121.3
640	H	30.5	Very low	34.1	Very low	175 Å²	175	140 Å²	140	81%	0.81	80%	0.798	S	S	*	*			trans	82.6	138.6	171.4	-59.2	-72.1	0	0	0	118.8
641	S	46	Very low	34.1	Very low	112 Å²	112	140.8 Å²	140.8	78%	0.783	80%	0.801	S	S	*	*			trans	-98.4	-179.9	-178	-29.8	0	0	0	0	109.1
642	P	42.4	Very low	33.9	Very low	107 Å²	107	143.9 Å²	143.9	70%	0.695	80%	0.803	S	S	*	*				-161	163	54.7	42.6	-19.9	0	0	0	121
643	K	30	Very low	33.9	Very low	192 Å²	192	143.2 Å²	143.2	84%	0.835	79%	0.79	S	S	*	*			trans	65.6	161.7	138.2	-76.8	176.1	177.2	178.5	0	122.7
644	T	35.1	Very low	34.1	Very low	134 Å²	134	139.9 Å²	139.9	82%	0.822	78%	0.782	S	S	*	*			trans	70.1	162	167	73.7	0	0	0	0	118.7
645	S	30.2	Very low	34.2	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	77%	0.771	S	S	*	*				-166.2	158.6	-53.4	60.4	0	0	0	0	110.8
646	S	33.2	Very low	34.3	Very low	126 Å²	126	138.6 Å²	138.6	88%	0.881	77%	0.767	S	S	*	*			trans	67.6	156.3	169.8	81.3	0	0	0	0	116.5
647	G	32.5	Very low	34.3	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	76%	0.764	S	S	*	*			cis	168.5	153.7	-13.5	0	0	0	0	0	115
648	G	32.4	Very low	34.8	Very low	75 Å²	75	137.6 Å²	137.6	77%	0.773	77%	0.765	S	S	*	*			trans	80.8	164.9	168.3	0	0	0	0	0	116.2
649	K	35.5	Very low	34.8	Very low	211 Å²	211	134.2 Å²	134.2	92%	0.917	76%	0.762	S	S	*	*			cis	-153.6	132	-13.5	-123.2	176.1	-176.6	178	0	109.1
650	G	32.9	Very low	34.9	Very low	78 Å²	78	133.4 Å²	133.4	80%	0.804	76%	0.761	S	S	*	*			trans	-86.9	163.3	176	0	0	0	0	0	113.1
651	I	35.3	Very low	35.1	Very low	169 Å²	169	135.8 Å²	135.8	87%	0.867	76%	0.763	S	S	*	*			trans	-84.9	126.9	-174.4	-60.4	168.9	0	0	0	111.6
652	Q	29.6	Very low	34.8	Very low	179 Å²	179	135.9 Å²	135.9	84%	0.836	77%	0.77	S	S	*	*			trans	-155.4	144	152	-83.1	-157	-10.9	0	0	110.2
653	P	39.7	Very low	34.2	Very low	92 Å²	92	137.4 Å²	137.4	60%	0.597	77%	0.773	S	S	*	*			trans	-127.8	167.9	143.7	35.5	-23.8	0	0	0	112.9
654	N	40.3	Very low	34.5	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	77%	0.772	S	S	*	*			trans	61.2	81.2	175.4	-54.9	-9.1	0	0	0	114.5
655	I	32.9	Very low	34.3	Very low	113 Å²	113	141 Å²	141	58%	0.579	77%	0.771	S	S	*	*			cis	74.2	84.4	40.2	-47.5	159.4	0	0	0	114.2
656	H	32.6	Very low	34.7	Very low	168 Å²	168	143.3 Å²	143.3	78%	0.778	77%	0.771	S	S	*	*				-145.6	135.6	106.4	-99.1	63.2	0	0	0	106.7
657	K	34.5	Very low	34.6	Very low	154 Å²	154	146.1 Å²	146.1	67%	0.67	77%	0.77	S	S	*	*				61.5	74.9	53.9	-66.4	-173	177.1	-178.9	0	112.8
658	D	39.9	Very low	34.8	Very low	146 Å²	146	147.7 Å²	147.7	78%	0.781	77%	0.77	S	S	*	*				-176.6	161	113.6	-90.3	-19.6	0	0	0	111.5
659	N	31.7	Very low	35.3	Very low	124 Å²	124	149.2 Å²	149.2	66%	0.663	77%	0.766	S	S	*	*				-159.9	156.7	-52.7	-129.7	-40.2	0	0	0	109.7
660	I	36	Very low	35.2	Very low	129 Å²	129	146.2 Å²	146.2	66%	0.662	76%	0.758	S	S	*	*			trans	66.9	107.8	153.7	-63	165.8	0	0	0	119.2
661	R	34.9	Very low	35.4	Very low	225 Å²	225	150.3 Å²	150.3	85%	0.849	76%	0.761	S	S	*	*			trans	65.8	93.8	145.3	-65.3	173.2	-178.1	170.2	0.9	120.6
662	A	39.3	Very low	35.7	Very low	114 Å²	114	154.5 Å²	154.5	94%	0.942	77%	0.766	S	S	*	*				-111.4	71.9	129.5	0	0	0	0	0	109.5
663	N	30.6	Very low	36.1	Very low	140 Å²	140	150.4 Å²	150.4	75%	0.749	76%	0.762	S	S	*	*			trans	-147.6	78.9	-172.9	-166.3	2.6	0	0	0	114.9
664	R	34.7	Very low	35.9	Very low	219 Å²	219	155.2 Å²	155.2	83%	0.826	77%	0.774	S	S	*	*			trans	-161.1	131.8	146.2	-104.2	172.9	161.9	147.2	-2.2	105.5
665	K	32.1	Very low	35.9	Very low	182 Å²	182	154.4 Å²	154.4	79%	0.791	78%	0.776	S	S	*	*				68	153.3	60.1	-90.8	-170.5	174.7	-175.4	0	113.7
666	E	38.5	Very low	36.2	Very low	145 Å²	145	155.5 Å²	155.5	68%	0.678	79%	0.789	S	S	*	*			trans	63.4	114	-165.3	-66.3	110.7	-104.2	0	0	113.4
667	Q	31.2	Very low	36.3	Very low	185 Å²	185	157.9 Å²	157.9	86%	0.864	79%	0.791	S	S	*	*				74.7	125	60.3	-66.5	-173.5	-0.9	0	0	113.8
668	S	35.7	Very low	36.5	Very low	107 Å²	107	159 Å²	159	75%	0.748	80%	0.798	S	S	*	*			trans	-50.2	153.7	162.8	54.5	0	0	0	0	111.9
669	P	43.5	Very low	36.2	Very low	107 Å²	107	159.2 Å²	159.2	70%	0.695	79%	0.794	S	S	*	*				-155.8	178.5	50.9	44.2	-23.6	0	0	0	119.4
670	I	33.9	Very low	36.6	Very low	148 Å²	148	161.4 Å²	161.4	76%	0.759	81%	0.805	S	S	*	*			trans	43.1	116.3	145.1	-62.1	156.2	0	0	0	118.3
671	L	37.6	Very low	36.7	Very low	164 Å²	164	162 Å²	162	86%	0.859	81%	0.805	S	S	*	*				171.4	114.7	122	-93.3	-175.7	0	0	0	112.1
672	R	41.2	Very low	37.1	Very low	257 Å²	257	159.3 Å²	159.3	97%	0.97	80%	0.799	S	S	*	*			trans	-155.6	138.8	133.6	-136.3	168.1	-178.9	157.8	1.1	111
673	A	37.9	Very low	37.3	Very low	92 Å²	92	157.9 Å²	157.9	76%	0.76	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-90.9	169.8	-164.8	0	0	0	0	0	114.1
674	K	34	Very low	37.6	Very low	194 Å²	194	162.8 Å²	162.8	84%	0.843	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-72.4	131.2	176	-57.4	164.9	-175.1	167.4	0	110.2
675	P	42	Very low	38.1	Very low	129 Å²	129	163.4 Å²	163.4	84%	0.838	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70.3	133.3	161.4	29.7	-32.1	0	0	0	109.8
676	T	38.3	Very low	38.4	Very low	136 Å²	136	162 Å²	162	83%	0.834	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85.6	165.8	175.8	31.4	0	0	0	0	112.1
677	R	34	Very low	38.6	Very low	219 Å²	219	166.7 Å²	166.7	83%	0.826	82%	0.819	S	S	*	*			trans	-33.8	135.3	177.7	-77.2	171.4	156	155.7	-10.3	114.6
678	H	39.5	Very low	39.2	Very low	178 Å²	178	162.3 Å²	162.3	82%	0.824	81%	0.809	S	S	*	*			trans	-112	139.5	142.1	-127.2	-84	0	0	0	109.9
679	H	33	Very low	40.1	Very low	149 Å²	149	162.5 Å²	162.5	69%	0.69	81%	0.807	S	S	*	*			trans	-91	144.9	159.9	-82.6	-107.2	0	0	0	108.4
680	L	41.1	Very low	40.1	Very low	170 Å²	170	167 Å²	167	89%	0.89	81%	0.812	S	S	*	*			trans	-154.8	154.4	162.6	-113.9	164.1	0	0	0	108.7
681	E	37.9	Very low	40.3	Very low	141 Å²	141	168.5 Å²	168.5	66%	0.659	82%	0.815	S	S	*	*			trans	-113	156.8	-155.7	-68.9	-148.7	102	0	0	115.9	G683	E681-G683 PolarHBondContact O-N 3.28Å
682	K	42.2	Very low	40.3	Very low	170 Å²	170	165.7 Å²	165.7	74%	0.739	81%	0.809	S	S	*	*			trans	42.2	69.5	141.4	-60.6	161.2	-173	148.9	0	118.2
683	G	44.6	Very low	40.5	Very low	84 Å²	84	159.4 Å²	159.4	87%	0.866	80%	0.802	S	S	*	*			trans	-88.2	92.3	153.8	0	0	0	0	0	111.9	E681	E681-G683 PolarHBondContact O-N 3.28Å
684	R	37.4	Very low	40.8	Very low	243 Å²	243	162.5 Å²	162.5	92%	0.917	80%	0.804	S	S	*	*			trans	-94.7	103.7	168.5	-81	-168.2	-178.3	-169.9	5.2	110.2
685	R	43.9	Very low	41.2	Very low	231 Å²	231	157.8 Å²	157.8	87%	0.872	80%	0.801	S	S	*	*			trans	-138.2	116.2	153.4	-70.3	-167	177.3	155.8	1.8	110.5
686	D	39.5	Very low	41.1	Very low	153 Å²	153	156.3 Å²	156.3	82%	0.818	79%	0.794	S	S	*	*			trans	46.7	102.9	147.8	-46.3	-46	0	0	0	119.8
687	R	41.7	Very low	41.4	Very low	243 Å²	243	155.3 Å²	155.3	92%	0.917	79%	0.789	S	S	*	*			trans	-81.7	121.6	162.1	-67.4	170.1	170.2	161.1	-5.7	109.5
688	S	43.6	Very low	41.7	Very low	94 Å²	94	156.8 Å²	156.8	66%	0.657	80%	0.795	S	S	*	*			trans	-75.6	144	148.8	70.7	0	0	0	0	108.9	Y690	S688-Y690 PolarHBondContact O-N 2.92Å; S688-Y690 VanDerWaalsContact O-N 3.16Å
689	P	55.5	Low	41.8	Very low	111 Å²	111	154.2 Å²	154.2	72%	0.721	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-5.5	-169.8	-22	35.1	0	0	0	116.4
690	Y	43.3	Very low	42.4	Very low	202 Å²	202	151.2 Å²	151.2	79%	0.792	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	11.8	-157.9	-76.4	-76.3	0	0	0	116.7	S688	S688-Y690 PolarHBondContact O-N 2.92Å; S688-Y690 VanDerWaalsContact O-N 3.16Å
691	H	37.7	Very low	42.5	Very low	179 Å²	179	151.9 Å²	151.9	83%	0.829	79%	0.786	S	S	*	*			trans	-119.6	86.2	168	-82.5	6.2	0	0	0	111.7	P693	H691-P693 VanDerWaalsContact O-CD 3.3Å; H691-P693 WeakPolarHBondContact O-CD 3.23Å
692	S	39	Very low	42.5	Very low	104 Å²	104	153 Å²	153	73%	0.727	79%	0.79	S	S	*	*			trans	-84.8	107.7	158	-67.2	0	0	0	0	108.4	I694	S692-I694 PolarHBondContact O-N 2.69Å
693	P	45.2	Very low	42.7	Very low	126 Å²	126	156.2 Å²	156.2	82%	0.818	80%	0.798	S	S	*	*			trans	-66.8	107.4	177.3	26.9	-33.4	0	0	0	109.4	H691 A695	H691-P693 VanDerWaalsContact O-CD 3.3Å; H691-P693 WeakPolarHBondContact O-CD 3.23Å; P693-A695 PolarHBondContact O-N 3.48Å
694	I	44.3	Very low	42.6	Very low	157 Å²	157	161.4 Å²	161.4	81%	0.805	80%	0.799	S	S	*	*			trans	-67.9	103.7	171	-62.7	177.2	0	0	0	107	S692 S696	S692-I694 PolarHBondContact O-N 2.69Å; I694-S696 VanDerWaalsContact C-N 3.28Å; I694-S696 PolarHBondContact O-N 2.96Å
695	A	40.9	Very low	42.6	Very low	95 Å²	95	152.9 Å²	152.9	79%	0.785	79%	0.787	S	S	*	*			trans	-70.6	84.2	176.2	0	0	0	0	0	110.2	P693	P693-A695 PolarHBondContact O-N 3.48Å
696	S	41.5	Very low	42.6	Very low	98 Å²	98	153.8 Å²	153.8	69%	0.685	79%	0.79	S	S	*	*			trans	-52.3	123	172.8	-66.4	0	0	0	0	110.1	I694 R698	I694-S696 VanDerWaalsContact C-N 3.28Å; I694-S696 PolarHBondContact O-N 2.96Å; S696-R698 PolarHBondContact O-N 3.09Å
697	P	43	Very low	42.7	Very low	114 Å²	114	155.5 Å²	155.5	74%	0.74	79%	0.793	S	S	*	*			trans	-70.9	108.5	-168.9	26.3	-34.2	0	0	0	111.4	V699	P697-V699 HydrophobicContact CB-CG2 4.48Å; P697-V699 PolarHBondContact O-N 2.98Å
698	R	42.1	Very low	42.6	Very low	250 Å²	250	146.9 Å²	146.9	94%	0.943	78%	0.78	S	S	*	*			trans	-63.2	93.1	165.9	-83.9	-178.2	165	172.7	-4.7	109.9	S696	S696-R698 PolarHBondContact O-N 3.09Å
699	V	40	Very low	42.8	Very low	124 Å²	124	150.7 Å²	150.7	75%	0.752	79%	0.787	S	S	*	*			trans	-100.4	90.1	166.1	-175.5	0	0	0	0	108	P697	P697-V699 HydrophobicContact CB-CG2 4.48Å; P697-V699 PolarHBondContact O-N 2.98Å
700	S	46.5	Very low	41.9	Very low	87 Å²	87	153.1 Å²	153.1	61%	0.608	79%	0.788	S	S	*	*			trans	-69.8	131.9	175.3	43.3	0	0	0	0	111	H702	S700-H702 PolarHBondContact O-N 3.26Å; S700-H702 VanDerWaalsContact O-N 3.09Å
701	H	42	Very low	41.9	Very low	184 Å²	184	152.7 Å²	152.7	85%	0.852	79%	0.79	S	S	*	*			trans	-70.1	103.5	169.9	-74.1	-68.2	0	0	0	110.1
702	H	39.4	Very low	42.4	Very low	163 Å²	163	152.2 Å²	152.2	76%	0.755	79%	0.793	S	S	*	*			trans	-116.7	97	168.5	-81.2	9.8	0	0	0	110.7	S700 H704	S700-H702 PolarHBondContact O-N 3.26Å; S700-H702 VanDerWaalsContact O-N 3.09Å; H702-H704 VanDerWaalsContact C-N 3.35Å; H702-H704 PolarHBondContact O-N 2.96Å
703	R	45.4	Very low	42.4	Very low	238 Å²	238	154.7 Å²	154.7	90%	0.898	80%	0.798	S	S	*	*			trans	-84.6	67.8	170.6	-77.8	-175.3	170.2	-177.9	-0.3	111.5
704	H	41.8	Very low	42.4	Very low	193 Å²	193	160.4 Å²	160.4	89%	0.894	80%	0.804	S	S	*	*			trans	-156.6	151.1	156	-72.9	-63	0	0	0	106.6	H702	H702-H704 VanDerWaalsContact C-N 3.35Å; H702-H704 PolarHBondContact O-N 2.96Å
705	G	37.6	Very low	42.2	Very low	64 Å²	64	162.1 Å²	162.1	66%	0.66	81%	0.805	S	S	*	*			cis	-170.3	176.2	-1.7	0	0	0	0	0	107.1	H707	G705-H707 PolarHBondContact O-N 3.16Å
706	R	43.9	Very low	41.9	Very low	250 Å²	250	163.8 Å²	163.8	94%	0.943	81%	0.806	S	S	*	*			trans	-75	98.3	180	-71.2	-172.9	-175.1	179.3	4.9	111.6
707	H	41.8	Very low	41.6	Very low	190 Å²	190	171 Å²	171	88%	0.88	82%	0.818	S	S	*	*			trans	-120.3	103.4	155.8	-75.7	0.8	0	0	0	108.7	G705	G705-H707 PolarHBondContact O-N 3.16Å
708	G	41.4	Very low	41.7	Very low	61 Å²	61	175.6 Å²	175.6	63%	0.629	83%	0.827	S	S	*	*			trans	-81.4	149.1	145.1	0	0	0	0	0	107.5
709	H	47	Very low	41.6	Very low	174 Å²	174	169.6 Å²	169.6	81%	0.806	82%	0.823	S	S	*	*				179.7	151.1	123.2	-103.6	-84.7	0	0	0	110.7
710	H	35.7	Very low	41.8	Very low	163 Å²	163	169.5 Å²	169.5	76%	0.755	83%	0.828	S	S	*	*			trans	50.5	121	171.2	-62.7	-68.8	0	0	0	121.4
711	K	43.3	Very low	41.5	Very low	192 Å²	192	169 Å²	169	84%	0.835	84%	0.837	S	S	*	*			trans	-63.4	140.2	159.1	-53.6	166.6	-177.3	171.6	0	109.2
712	L	48.9	Very low	41.7	Very low	170 Å²	170	172.4 Å²	172.4	89%	0.89	84%	0.842	S	S	*	*			trans	-116.8	104.1	159	-73.8	177.4	0	0	0	109.8	R714	L712-R714 PolarHBondContact O-N 3.18Å
713	N	38.5	Very low	41.9	Very low	156 Å²	156	174.2 Å²	174.2	83%	0.834	85%	0.848	S	S	*	*			trans	-73.4	113.8	167.2	-84	-23.3	0	0	0	108.9
714	R	45	Very low	42.2	Very low	246 Å²	246	167.6 Å²	167.6	93%	0.928	84%	0.835	S	S	*	*			trans	-124.4	116.1	158.8	-97.9	-176	168.4	169.4	-2.6	110.1	L712	L712-R714 PolarHBondContact O-N 3.18Å
715	K	40.1	Very low	42.8	Very low	192 Å²	192	166.7 Å²	166.7	84%	0.835	83%	0.831	S	S	*	*			trans	-80.9	160.8	176.5	-74.9	-178.2	175.8	177.4	0	110.9
716	T	35.1	Very low	43.4	Very low	131 Å²	131	171.3 Å²	171.3	80%	0.804	84%	0.835	S	S	*	*			trans	54.8	114.1	153	48.4	0	0	0	0	119.9
717	R	36.1	Very low	43.6	Very low	248 Å²	248	167.5 Å²	167.5	94%	0.936	83%	0.828	S	S	*	*				-149	145.8	100.9	-109.4	177	173.6	-177.2	-3.3	110.3
718	K	43.4	Very low	43.8	Very low	212 Å²	212	170.2 Å²	170.2	92%	0.922	83%	0.83	S	S	*	*			trans	-85.8	149.5	171.4	-63.9	178	-178.5	175.8	0	108.9
719	S	41.8	Very low	43.8	Very low	124 Å²	124	175 Å²	175	87%	0.867	84%	0.84	S	S	*	*			trans	-143.1	159.7	162.7	54.1	0	0	0	0	109.9
720	S	43.2	Very low	43.4	Very low	122 Å²	122	171.8 Å²	171.8	85%	0.853	84%	0.838	S	S	*	*			trans	-82.6	155.8	-165.2	39.8	0	0	0	0	114.1
721	G	40.1	Very low	43.7	Very low	77 Å²	77	170.4 Å²	170.4	79%	0.794	84%	0.843	S	S	*	*			trans	-85.9	179.3	-173.9	0	0	0	0	0	115.2
722	R	47	Very low	43.6	Very low	254 Å²	254	165.8 Å²	165.8	96%	0.958	84%	0.841	S	S	*	*			trans	-124.5	140.3	166	-71.5	-173.2	171	-134.9	-4	109.9
723	K	43.6	Very low	43.6	Very low	202 Å²	202	169.8 Å²	169.8	88%	0.878	84%	0.844	S	S	*	*			trans	-85	165.6	177.9	-94	-178.3	176.6	179.2	0	111.6
724	P	51.6	Low	44.1	Very low	99 Å²	99	170.4 Å²	170.4	64%	0.643	84%	0.839	S	S	*	*			trans	-91.6	170.6	-167.4	37.4	-37.4	0	0	0	114.2
725	H	54.8	Low	43.9	Very low	174 Å²	174	167.2 Å²	167.2	81%	0.806	83%	0.834	S	S	*	*			trans	-106.3	138.6	164.1	-76.2	-94.2	0	0	0	111
726	H	48.6	Very low	43.9	Very low	161 Å²	161	162 Å²	162	75%	0.745	83%	0.827	S	S	*	*			trans	-125.9	117.3	176.2	-74.8	-91.2	0	0	0	110.5
727	H	48.7	Very low	44.4	Very low	170 Å²	170	166 Å²	166	79%	0.787	83%	0.834	S	S	*	*			trans	-150.4	148.5	166.7	-55.4	-84	0	0	0	109.6
728	R	46.5	Very low	44.7	Very low	247 Å²	247	158.8 Å²	158.8	93%	0.932	83%	0.827	S	S	*	*			cis	-149.2	156.6	-47.4	-158.3	173.8	-175.8	171.8	1	106
729	L	40.9	Very low	44.8	Very low	161 Å²	161	158.4 Å²	158.4	84%	0.843	83%	0.825	S	S	*	*			trans	-97.1	157.5	-172.2	-74.2	168.7	0	0	0	114.1
730	S	37.7	Very low	45.3	Very low	107 Å²	107	161.7 Å²	161.7	75%	0.748	82%	0.824	S	S	*	*			trans	72.9	155.9	163.3	-48.6	0	0	0	0	115
731	P	43.4	Very low	45.3	Very low	134 Å²	134	161 Å²	161	87%	0.87	82%	0.819	S	S	*	*				-114	168.6	63.1	38.3	-35.9	0	0	0	115.1
732	A	40.3	Very low	45.3	Very low	95 Å²	95	165.9 Å²	165.9	79%	0.785	81%	0.814	S	S	*	*			trans	-121.1	146.6	170.6	0	0	0	0	0	110.2
733	R	49.5	Very low	44.8	Very low	253 Å²	253	159.3 Å²	159.3	96%	0.955	81%	0.807	S	S	*	*			trans	-113.1	150.2	169.6	-146.9	170.7	-173.5	178.8	1.1	109.6
734	K	48.5	Very low	44.5	Very low	169 Å²	169	153.5 Å²	153.5	74%	0.735	80%	0.804	S	S	*	*			trans	-117.7	172.8	-165.1	-67.8	176.7	-178.4	173.8	0	112
735	H	40.8	Very low	43.8	Very low	179 Å²	179	160.5 Å²	160.5	83%	0.829	82%	0.818	S	S	*	*			trans	77.8	150.4	168.7	-41	-80.4	0	0	0	114.7
736	A	41.2	Very low	42.9	Very low	82 Å²	82	161.8 Å²	161.8	68%	0.678	82%	0.821	S	S	*	*			cis	-148.2	146.8	5.7	0	0	0	0	0	114.8
737	K	44.9	Very low	42.4	Very low	217 Å²	217	158.5 Å²	158.5	94%	0.943	82%	0.822	S	S	*	*			trans	58.2	160.2	154.9	-67.7	177.2	179.2	174.3	0	118.6
738	A	43.1	Very low	41.9	Very low	96 Å²	96	158.6 Å²	158.6	79%	0.793	82%	0.822	S	S	*	*			trans	-129	142.2	-164.6	0	0	0	0	0	114.1
739	K	43.8	Very low	41.4	Very low	204 Å²	204	155.5 Å²	155.5	89%	0.887	82%	0.816	S	S	*	*			trans	-123.6	144.2	150.1	-76.2	-176.1	178.2	175.3	0	108.4	S741	K739-S741 PolarHBondContact O-N 3.37Å
740	K	52.5	Low	41.5	Very low	192 Å²	192	155.7 Å²	155.7	84%	0.835	81%	0.812	S	S	*	*			trans	-84.9	96.2	-172.7	-71.5	170.3	178.7	164.4	0	111.7
741	S	44.1	Very low	41.2	Very low	109 Å²	109	158.6 Å²	158.6	76%	0.762	81%	0.813	S	S	*	*			trans	-87.7	157.5	149	63.8	0	0	0	0	109.5	K739	K739-S741 PolarHBondContact O-N 3.37Å
742	R	39.3	Very low	41	Very low	179 Å²	179	164.1 Å²	164.1	68%	0.675	82%	0.817	S	S	*	*			trans	-122.1	63.1	-158	-169.7	179.7	154.5	121.4	-13.9	113.6	K911 S912	R742-K911 PolarHBondContact NH1-O 3.36Å; R742-K911 PolarHBondContact NH2-O 3.33Å; R742-S912 PolarHBondContact NH1-OG 2.68Å
743	S	36.8	Very low	40.9	Very low	116 Å²	116	168.3 Å²	168.3	81%	0.811	82%	0.817	S	S	*	*			trans	-143	131.5	170.9	48.8	0	0	0	0	110.6
744	G	37.6	Very low	40.3	Very low	80 Å²	80	163.5 Å²	163.5	83%	0.825	81%	0.811	S	S	*	*			trans	152.9	71.2	-175	0	0	0	0	0	113.6
745	R	36	Very low	39.9	Very low	246 Å²	246	167.2 Å²	167.2	93%	0.928	82%	0.82	S	S	*	*			trans	-136.4	138.9	171.1	-93.2	-171	168.1	-166.7	-4.5	110.9
746	K	36.8	Very low	39.8	Very low	200 Å²	200	168.1 Å²	168.1	87%	0.87	82%	0.821	S	S	*	*			trans	80.4	101.9	176.3	-54.6	-179.6	179.4	-178.8	0	116.9
747	A	38.4	Very low	39.6	Very low	92 Å²	92	170.7 Å²	170.7	76%	0.76	83%	0.829	S	S	*	*			trans	-151.5	25.5	136	0	0	0	0	0	112.9	K749	A747-K749 PolarHBondContact O-N 3.1Å
748	E	36.8	Very low	39.3	Very low	172 Å²	172	166.7 Å²	166.7	80%	0.804	82%	0.823	S	S	*	*			trans	-69.8	127	178	-173.4	156	-139.1	0	0	111.2	H750	E748-H750 PolarHBondContact O-N 3.4Å
749	K	36.4	Very low	38.9	Very low	182 Å²	182	167.8 Å²	167.8	79%	0.791	82%	0.822	S	S	*	*			trans	-97.9	89.3	-167.4	-62.9	169.9	-175	166.6	0	110.5	A747	A747-K749 PolarHBondContact O-N 3.1Å
750	H	43.4	Very low	38.6	Very low	165 Å²	165	166.3 Å²	166.3	76%	0.764	82%	0.818	S	S	*	*			trans	-86.1	128	165.4	-78.9	-67.8	0	0	0	112.5	E748	E748-H750 PolarHBondContact O-N 3.4Å
751	H	31.5	Very low	37.9	Very low	168 Å²	168	167.8 Å²	167.8	78%	0.778	82%	0.819	S	S	*	*			trans	-68.1	145.5	-176.9	-67.3	-133.9	0	0	0	111.1
752	R	38.3	Very low	37.7	Very low	250 Å²	250	167.7 Å²	167.7	94%	0.943	82%	0.818	S	S	*	*			trans	-166.7	87.5	138.5	-103.1	153.5	-166.5	-164.9	3.6	110.5
753	K	38.1	Very low	37.7	Very low	184 Å²	184	163 Å²	163	80%	0.8	83%	0.825	S	S	*	*			trans	-66.4	-179.7	134.9	-75.3	-175.4	175.5	179.7	0	108.1
754	D	37.4	Very low	38.2	Very low	152 Å²	152	166.5 Å²	166.5	81%	0.813	83%	0.826	S	S	*	*			trans	69.2	67.8	168.3	-44.4	-33.3	0	0	0	115.8
755	R	40.5	Very low	38.8	Very low	246 Å²	246	170.8 Å²	170.8	93%	0.928	82%	0.824	S	S	*	*			trans	-133.9	86	140.3	-120.7	178.2	-175.4	-175.7	-0.3	111.7
756	K	39.1	Very low	39.7	Very low	198 Å²	198	166.9 Å²	166.9	86%	0.861	82%	0.821	S	S	*	*			trans	23.6	101	153.6	-58.4	-175.9	179.2	-175.1	0	116.6	T758	K756-T758 PolarHBondContact O-N 2.83Å
757	T	36.9	Very low	40.7	Very low	137 Å²	137	161 Å²	161	84%	0.84	81%	0.805	S	S	*	*			trans	-82.4	95.2	157.4	47.7	0	0	0	0	109.9	P759	T757-P759 WeakPolarHBondContact O-CD 3.42Å
758	T	38.1	Very low	41.5	Very low	132 Å²	132	161.8 Å²	161.8	81%	0.81	80%	0.797	S	S	*	*			trans	-77	118.6	162.8	20.6	0	0	0	0	109.2	K756	K756-T758 PolarHBondContact O-N 2.83Å
759	P	35.8	Very low	42.7	Very low	120 Å²	120	162.1 Å²	162.1	78%	0.779	80%	0.795	S	S	*	*			trans	-108.3	87.7	-168.7	37.7	-28.8	0	0	0	113.1	T757	T757-P759 WeakPolarHBondContact O-CD 3.42Å
760	E	37.8	Very low	43.4	Very low	173 Å²	173	159 Å²	159	81%	0.808	78%	0.783	S	S	*	*			trans	-128.4	158.5	-179.8	-72.5	-132.5	132.1	0	0	115.5
761	R	38	Very low	44.6	Very low	223 Å²	223	160.5 Å²	160.5	84%	0.842	78%	0.782	S	S	*	*			trans	59.3	69.2	168.3	-70.3	-175.6	172	179	-3	119.3
762	S	37.9	Very low	46.1	Very low	107 Å²	107	159.1 Å²	159.1	75%	0.748	78%	0.776	S	S	*	*				44.8	91.4	117.2	63	0	0	0	0	120.3	K764	S762-K764 VanDerWaalsContact C-N 3.33Å
763	G	40.1	Very low	47.8	Very low	80 Å²	80	153.5 Å²	153.5	83%	0.825	76%	0.758	S	S	*	*			trans	-86.2	14.8	159.3	0	0	0	0	0	115.5	Q765	G763-Q765 PolarHBondContact O-N 3.42Å
764	K	47.7	Very low	49.3	Very low	189 Å²	189	152.9 Å²	152.9	82%	0.822	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	69	-171.9	-74.9	-175.4	175.8	176	0	113.4	S762	S762-K764 VanDerWaalsContact C-N 3.33Å
765	Q	50.7	Low	50.9	Low	171 Å²	171	153.6 Å²	153.6	80%	0.799	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.8	-17.5	168	-76.6	-165.2	-12.8	0	0	115.6	G763 S767	G763-Q765 PolarHBondContact O-N 3.42Å; Q765-S767 VanDerWaalsContact C-N 3.34Å; Q765-S767 PolarHBondContact O-N 2.85Å
766	L	54	Low	52.2	Low	163 Å²	163	151.8 Å²	151.8	85%	0.853	74%	0.74	S	S	*	*	H	α-helix	trans	-77.9	-11.2	-177.5	-63.1	179	0	0	0	115
767	S	58.6	Low	53.4	Low	76 Å²	76	146.2 Å²	146.2	53%	0.531	72%	0.72	S	S	.	*	H	α-helix	trans	-75.5	-31.4	-179	55.1	0	0	0	0	114.5	Q765	Q765-S767 VanDerWaalsContact C-N 3.34Å; Q765-S767 PolarHBondContact O-N 2.85Å
768	N	55.2	Low	55.2	Low	110 Å²	110	147.5 Å²	147.5	59%	0.588	71%	0.714	S	S	*	*	H	α-helix	trans	-80.1	-41.7	-167.8	-71.4	4.9	0	0	0	112.5	H770 R771 E772	N768-H770 PolarHBondContact O-N 3.44Å; N768-H770 VanDerWaalsContact O-N 3.16Å; N768-R771 WeakPolarHBondContact O-CB 3.48Å; N768-R771 PolarHBondContact O-N 3.24Å; N768-E772 PolarHBondContact O-N 3.46Å
769	K	60.5	Low	56.4	Low	178 Å²	178	144 Å²	144	77%	0.774	70%	0.699	S	S	*	*	H	α-helix	trans	-55.8	-33.3	175.2	-79.3	-170.7	172.8	-177.2	0	113
770	H	52.3	Low	57.7	Low	117 Å²	117	148.1 Å²	148.1	54%	0.542	70%	0.699	S	S	.	*	H	α-helix	trans	-76.8	-26.4	176.9	-164.6	60.8	0	0	0	113.6	N768 R774	N768-H770 PolarHBondContact O-N 3.44Å; N768-H770 VanDerWaalsContact O-N 3.16Å; H770-R774 PolarHBondContact NE2-NE 2.98Å; H770-R774 PolarHBondContact NE2-NH2 3.25Å; H770-R774 WeakPolarHBondContact O-CG 3.48Å
771	R	67.8	Low	58.7	Low	197 Å²	197	146.5 Å²	146.5	74%	0.743	70%	0.695	S	S	*	*	H	α-helix	trans	-76	-32	177.3	-169.8	175.7	-175.8	-178	-0.1	112.4	N768	N768-R771 WeakPolarHBondContact O-CB 3.48Å; N768-R771 PolarHBondContact O-N 3.24Å
772	E	64.3	Low	59.7	Low	139 Å²	139	143.6 Å²	143.6	65%	0.65	69%	0.691	S	S	*	*	H	α-helix	trans	-76.4	-45.4	-175.9	-168.9	158.6	-131.5	0	0	112.8	N768 R774 K775	N768-E772 PolarHBondContact O-N 3.46Å; E772-R774 VanDerWaalsContact C-N 3.26Å; E772-R774 PolarHBondContact O-N 3.11Å; E772-K775 PolarHBondContact O-N 3.49Å
773	K	72.3	Confident	60.5	Low	131 Å²	131	145.1 Å²	145.1	57%	0.57	69%	0.686	S	S	*	*	H	α-helix	trans	-56.4	-40.2	176.3	-168.4	166.4	-177.1	171.9	0	112	K775 R776 D777	K773-K775 PolarHBondContact O-N 3.3Å; K773-K775 VanDerWaalsContact O-N 3.11Å; K773-R776 PolarHBondContact O-N 3.1Å; K773-D777 PolarHBondContact O-N 3.15Å
774	R	71.4	Confident	60.9	Low	171 Å²	171	149.6 Å²	149.6	65%	0.645	69%	0.685	S	S	*	*	H	α-helix	trans	-61.7	-15.7	176.3	-70.4	-176	-177	-139.9	1	115.2	H770 E772	H770-R774 PolarHBondContact NE2-NE 2.98Å; H770-R774 PolarHBondContact NE2-NH2 3.25Å; H770-R774 WeakPolarHBondContact O-CG 3.48Å; E772-R774 VanDerWaalsContact C-N 3.26Å; E772-R774 PolarHBondContact O-N 3.11Å
775	K	71.1	Confident	60.8	Low	168 Å²	168	149.5 Å²	149.5	73%	0.73	68%	0.684	S	S	*	*	H	α-helix	trans	-82.3	-46.7	174.3	-82.8	-168.4	169.7	-169	0	112.4	E772 K773 D777 K778	E772-K775 PolarHBondContact O-N 3.49Å; K773-K775 PolarHBondContact O-N 3.3Å; K773-K775 VanDerWaalsContact O-N 3.11Å; K775-D777 PolarHBondContact O-N 3.34Å; K775-K778 PolarHBondContact O-N 3.02Å
776	R	67.1	Low	60.4	Low	207 Å²	207	147.3 Å²	147.3	78%	0.781	68%	0.683	S	S	*	*	H	α-helix	trans	-62.3	-44.2	-176.8	-74.5	-173.9	175	176.9	-1.3	111.8	K773 K778 A779	K773-R776 PolarHBondContact O-N 3.1Å; R776-K778 PolarHBondContact O-N 2.96Å; R776-K778 VanDerWaalsContact O-N 3.12Å; R776-A779 PolarHBondContact O-N 3.07Å
777	D	64.4	Low	59.3	Low	81 Å²	81	147 Å²	147	43%	0.433	68%	0.676	S	S	.	*	H	α-helix	trans	-57.7	-27.2	178.9	-61.5	-1.1	0	0	0	113.1	K773 K775	K773-D777 PolarHBondContact O-N 3.15Å; K775-D777 PolarHBondContact O-N 3.34Å
778	K	74.1	Confident	58.3	Low	164 Å²	164	149.2 Å²	149.2	71%	0.713	69%	0.689	S	S	*	*	H	α-helix	trans	-88.9	-19.9	-176.8	-157.3	173.4	-176.1	-176.6	0	114	K775 R776	K775-K778 PolarHBondContact O-N 3.02Å; R776-K778 PolarHBondContact O-N 2.96Å; R776-K778 VanDerWaalsContact O-N 3.12Å
779	A	64.3	Low	57.4	Low	60 Å²	60	152.4 Å²	152.4	50%	0.496	70%	0.7	S	S	.	*	H	α-helix	trans	-74.6	-53	177.4	0	0	0	0	0	111.5	R776 L781 Q782	R776-A779 PolarHBondContact O-N 3.07Å; A779-L781 PolarHBondContact O-N 2.79Å; A779-Q782 PolarHBondContact O-N 2.95Å
780	R	63.3	Low	56.3	Low	206 Å²	206	153.4 Å²	153.4	78%	0.777	71%	0.705	S	S	*	*	H	α-helix	trans	-57.4	-21.7	179.2	-85.5	-174.1	164.1	-171.2	-6.7	114.8	Q782	R780-Q782 VanDerWaalsContact C-N 3.3Å
781	L	57.5	Low	55.6	Low	138 Å²	138	154.2 Å²	154.2	72%	0.723	72%	0.721	S	S	*	*	H	α-helix	trans	-86.8	1.6	-178.5	-126.4	139.1	0	0	0	113.4	A779	A779-L781 PolarHBondContact O-N 2.79Å
782	Q	59.8	Low	54	Low	163 Å²	163	149.5 Å²	149.5	76%	0.762	72%	0.723	S	S	*	*	H	α-helix	trans	-105.8	-18.9	179.4	-162.8	163.3	-4.8	0	0	113.3	A779 R780	A779-Q782 PolarHBondContact O-N 2.95Å; R780-Q782 VanDerWaalsContact C-N 3.3Å
783	E	54.6	Low	52.5	Low	138 Å²	138	146.7 Å²	146.7	65%	0.645	73%	0.732	S	S	*	*	H	α-helix	trans	-76.7	-36.4	-179.2	-67.5	165.5	146.6	0	0	112.4	K785	E783-K785 VanDerWaalsContact C-N 3.3Å; E783-K785 PolarHBondContact O-N 2.76Å; E783-K785 VanDerWaalsContact O-N 3.15Å
784	H	48.8	Very low	50.6	Low	174 Å²	174	150.1 Å²	150.1	81%	0.806	74%	0.741	S	S	*	*	S	Bend	trans	-88.9	43.3	-178.2	-72.5	-75.5	0	0	0	114.6
785	K	44.8	Very low	48.7	Very low	187 Å²	187	150.9 Å²	150.9	81%	0.813	75%	0.752	S	S	*	*			trans	-134.6	52.5	167.6	-74.2	-159.9	173.1	-167.3	0	112.4	E783	E783-K785 VanDerWaalsContact C-N 3.3Å; E783-K785 PolarHBondContact O-N 2.76Å; E783-K785 VanDerWaalsContact O-N 3.15Å
786	V	42.1	Very low	46.7	Very low	125 Å²	125	149.4 Å²	149.4	76%	0.758	75%	0.747	S	S	*	*			trans	-100.8	135.2	167.6	-179.5	0	0	0	0	109.1
787	H	30.7	Very low	45.2	Very low	156 Å²	156	147.2 Å²	147.2	72%	0.722	75%	0.75	S	S	*	*			trans	11.9	121	171.1	-89.6	-79.5	0	0	0	121	E789	H787-E789 HydrophobicContact CB-CG 4.44Å
788	P	37.5	Very low	43.5	Very low	124 Å²	124	150 Å²	150	81%	0.805	75%	0.754	S	S	*	*	P	Polyproline II helix		-74.5	128.3	129.7	32.6	-29	0	0	0	109.6
789	E	37.1	Very low	41.5	Very low	176 Å²	176	149.3 Å²	149.3	82%	0.822	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-86.2	158.2	171.2	-65.3	-174.1	120.4	0	0	111.2	H787	H787-E789 HydrophobicContact CB-CG 4.44Å
790	K	37	Very low	39.8	Very low	200 Å²	200	152.1 Å²	152.1	87%	0.87	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-95.5	127.8	172.1	-68	-178.2	179	-179.6	0	109
791	P	37.2	Very low	38.4	Very low	134 Å²	134	152 Å²	152	87%	0.87	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-69.1	141.2	178	28.9	-34.5	0	0	0	111.3
792	A	34.8	Very low	36.9	Very low	97 Å²	97	154.2 Å²	154.2	80%	0.802	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-94.1	129.8	177.3	0	0	0	0	0	111.9
793	G	33.3	Very low	36.2	Very low	80 Å²	80	151.1 Å²	151.1	83%	0.825	76%	0.759	S	S	*	*			trans	-100.2	105.6	153.7	0	0	0	0	0	107.3
794	R	31.9	Very low	34.9	Very low	203 Å²	203	149.6 Å²	149.6	77%	0.766	76%	0.764	S	S	*	*				72.1	88.7	63.2	-164.6	-176.5	-168.9	-171.3	5.6	112.3	H796	R794-H796 PolarHBondContact NE-NE2 3.33Å; R794-H796 PolarHBondContact NH2-NE2 3.21Å
795	H	32.2	Very low	34.2	Very low	188 Å²	188	148.8 Å²	148.8	87%	0.87	76%	0.76	S	S	*	*			trans	-130.4	132.4	156.2	-126.4	-83.7	0	0	0	108.4
796	H	28.2	Very low	33.5	Very low	137 Å²	137	147.8 Å²	147.8	63%	0.634	76%	0.759	S	S	*	*			trans	-102.3	146.1	177.4	-72.9	-85.5	0	0	0	110.7	R794	R794-H796 PolarHBondContact NE-NE2 3.33Å; R794-H796 PolarHBondContact NH2-NE2 3.21Å
797	L	35.8	Very low	32.8	Very low	160 Å²	160	153.3 Å²	153.3	84%	0.838	77%	0.766	S	S	*	*			trans	-174.1	110.6	154.8	-96.4	147.6	0	0	0	104.2
798	R	29.4	Very low	33.2	Very low	140 Å²	140	151.2 Å²	151.2	53%	0.528	77%	0.766	S	S	.	*			cis	80.8	81.6	44.2	-163.5	-157.1	171.7	163.7	7.9	114.2	G463 E800	G463-R798 PolarHBondContact O-NH1 2.83Å; R798-E800 IonicContact CZ-OE1 2.65Å; R798-E800 IonicContact NE-OE1 3.9Å; R798-E800 IonicContact NH2-OE1 3.64Å; R798-E800 PolarHBondContact NH2-OE1 3.23Å
799	R	32	Very low	32.9	Very low	149 Å²	149	155.3 Å²	155.3	56%	0.562	77%	0.771	S	S	*	*			trans	-165.5	124.5	130.1	-96	-144.2	161.2	99.1	0.5	107.7	G462	G462-R799 VanDerWaalsContact O-CZ 3.28Å; G462-R799 PolarHBondContact O-NH1 3.12Å; G462-R799 PolarHBondContact O-NH2 2.79Å
800	E	27.4	Very low	32.8	Very low	120 Å²	120	150.4 Å²	150.4	56%	0.561	77%	0.768	S	S	*	*				76.7	89.9	75.1	-71.6	163.7	-158.4	0	0	112.2	R798	R798-E800 IonicContact CZ-OE1 2.65Å; R798-E800 IonicContact NE-OE1 3.9Å; R798-E800 IonicContact NH2-OE1 3.64Å; R798-E800 PolarHBondContact NH2-OE1 3.23Å
801	Q	34	Very low	32.7	Very low	203 Å²	203	150.1 Å²	150.1	95%	0.949	77%	0.767	S	S	*	*			trans	-133.4	135.5	146.7	-82.2	-168.2	-22.9	0	0	108.4
802	E	27.3	Very low	32.3	Very low	184 Å²	184	151.6 Å²	151.6	86%	0.86	76%	0.762	S	S	*	*			trans	-117.1	179.1	179.8	-114.9	-168.6	179.1	0	0	108.6
803	P	44	Very low	32.2	Very low	98 Å²	98	153.4 Å²	153.4	64%	0.636	76%	0.763	S	S	*	*			cis	-136.3	-173.5	-19.1	35.2	-16.5	0	0	0	113.7
804	S	26.6	Very low	32.7	Very low	107 Å²	107	155.9 Å²	155.9	75%	0.748	76%	0.762	S	S	*	*			trans	72.7	148.6	160.4	80	0	0	0	0	117
805	Q	34	Very low	33.4	Very low	156 Å²	156	151.8 Å²	151.8	73%	0.729	76%	0.762	S	S	*	*			cis	-143.2	158	36.1	-63.5	174.7	-6.7	0	0	114.6
806	Q	32	Very low	33.7	Very low	167 Å²	167	152.2 Å²	152.2	78%	0.78	76%	0.762	S	S	*	*			trans	39.1	115.7	145	-58.9	171.7	14.8	0	0	119.7
807	R	26.7	Very low	34	Very low	240 Å²	240	152.4 Å²	152.4	91%	0.906	77%	0.767	S	S	*	*				64.4	148.2	78.5	-79.5	-170.3	175.5	-168.3	2.3	115.1
808	P	39.5	Very low	33.8	Very low	113 Å²	113	152.3 Å²	152.3	73%	0.734	76%	0.762	S	S	*	*			cis	-138.4	164.9	-1.9	40.8	-22.5	0	0	0	118.6
809	K	31.5	Very low	33.8	Very low	209 Å²	209	152.5 Å²	152.5	91%	0.909	77%	0.769	S	S	*	*			trans	12.8	135.2	143.4	-52.8	177.6	179.9	-178.2	0	122.8
810	G	33.5	Very low	33.7	Very low	73 Å²	73	152 Å²	152	75%	0.753	77%	0.773	S	S	*	*			trans	153.1	114.3	148.5	0	0	0	0	0	111.8
811	K	35.4	Very low	34.2	Very low	194 Å²	194	151.6 Å²	151.6	84%	0.843	77%	0.771	S	S	*	*			cis	108.4	96.8	45	-94.2	-153.6	171.5	-170.7	0	112.7
812	H	29.6	Very low	34.4	Very low	166 Å²	166	151.6 Å²	151.6	77%	0.769	76%	0.763	S	S	*	*			trans	73.6	154.3	144.5	-75.2	-84.9	0	0	0	124.4
813	T	32.3	Very low	35.2	Very low	134 Å²	134	147.8 Å²	147.8	82%	0.822	76%	0.756	S	S	*	*			trans	72.1	94.7	155.9	39.9	0	0	0	0	120.8
814	T	43.5	Very low	35.5	Very low	132 Å²	132	148.5 Å²	148.5	81%	0.81	76%	0.761	S	S	*	*			trans	-73	170.8	137.4	49.8	0	0	0	0	111.4
815	P	47.3	Very low	35.7	Very low	118 Å²	118	152.4 Å²	152.4	77%	0.766	76%	0.764	S	S	*	*			cis	-113.5	166.2	-12.3	39.5	-29.1	0	0	0	112
816	K	38	Very low	36.1	Very low	197 Å²	197	156.3 Å²	156.3	86%	0.857	77%	0.773	S	S	*	*			trans	-162.9	157.7	159.7	-121.9	162.8	-172.2	177.7	0	114.9
817	D	33.6	Very low	36.2	Very low	141 Å²	141	157.3 Å²	157.3	75%	0.754	77%	0.774	S	S	*	*			trans	-52.4	140.2	163.3	-39.1	-97	0	0	0	111
818	H	31.3	Very low	36.9	Very low	157 Å²	157	150.8 Å²	150.8	73%	0.727	77%	0.771	S	S	*	*			trans	-164.4	165.7	142.4	-122.2	-106.2	0	0	0	111.3
819	E	30.2	Very low	36.7	Very low	145 Å²	145	156.2 Å²	156.2	68%	0.678	78%	0.777	S	S	*	*			trans	-9.1	151.3	145.5	-62.1	175.7	157.5	0	0	118.9
820	E	30.7	Very low	36.6	Very low	139 Å²	139	151.3 Å²	151.3	65%	0.65	78%	0.776	S	S	*	*			cis	-151.8	151.5	-1.4	-124.5	-167.9	157.4	0	0	117.3
821	Q	38	Very low	36.7	Very low	111 Å²	111	151.4 Å²	151.4	52%	0.519	78%	0.777	S	S	.	*			trans	7.5	124.8	138.1	-65.4	-170.1	82.2	0	0	120.5
822	R	36.8	Very low	36.7	Very low	203 Å²	203	147.4 Å²	147.4	77%	0.766	77%	0.773	S	S	*	*				50.8	97.6	120	-52.2	164.3	-175.5	170.6	-3.6	116.8
823	S	44.5	Very low	37.1	Very low	104 Å²	104	147.3 Å²	147.3	73%	0.727	77%	0.771	S	S	*	*	S	Bend	trans	-50.3	144.4	140	59.4	0	0	0	0	109.9	K825	S823-K825 PolarHBondContact O-N 3.48Å; S823-K825 VanDerWaalsContact O-N 3.15Å
824	P	50.8	Low	37.1	Very low	112 Å²	112	147.6 Å²	147.6	73%	0.727	76%	0.762	S	S	*	*	S	Bend	trans	-52.1	123.5	-174	16.3	-29.7	0	0	0	112.5	W826	P824-W826 PolarHBondContact O-N 3.28Å
825	K	30.3	Very low	36.8	Very low	190 Å²	190	149.7 Å²	149.7	83%	0.826	76%	0.763	S	S	*	*			trans	-52	81.9	-164.3	-178.3	-168	174.1	-176	0	115.2	S823	S823-K825 PolarHBondContact O-N 3.48Å; S823-K825 VanDerWaalsContact O-N 3.15Å
826	W	43.3	Very low	36.2	Very low	238 Å²	238	148.1 Å²	148.1	90%	0.902	76%	0.76	S	S	*	*			trans	-112.6	72.8	168.4	-72.9	98	0	0	0	113.1	P824 A828	P824-W826 PolarHBondContact O-N 3.28Å; W826-A828 PolarHBondContact O-N 2.91Å
827	K	33.6	Very low	36.3	Very low	188 Å²	188	148.3 Å²	148.3	82%	0.817	76%	0.761	S	S	*	*			trans	-64.4	88.8	152.6	-75.6	-174.3	176.8	-178.7	0	108.8	R829	K827-R829 PolarHBondContact O-N 3.2Å
828	A	41.5	Very low	36.5	Very low	102 Å²	102	146.7 Å²	146.7	84%	0.843	76%	0.756	S	S	*	*			trans	-62.3	97.4	147.1	0	0	0	0	0	106.2	W826	W826-A828 PolarHBondContact O-N 2.91Å
829	R	36.2	Very low	36.8	Very low	227 Å²	227	146.6 Å²	146.6	86%	0.857	76%	0.756	S	S	*	*			trans	-63.2	146.1	-162.6	-144.6	178.5	-177.5	-173.1	0.3	111.1	K827 G831	K827-R829 PolarHBondContact O-N 3.2Å; R829-G831 PolarHBondContact O-N 3.04Å
830	A	28.5	Very low	37.1	Very low	106 Å²	106	144.2 Å²	144.2	88%	0.876	76%	0.761	S	S	*	*			trans	-56.5	127.9	168.2	0	0	0	0	0	110.5
831	G	35.9	Very low	37.6	Very low	75 Å²	75	145.7 Å²	145.7	77%	0.773	77%	0.765	S	S	*	*			trans	-163.1	102.9	176.6	0	0	0	0	0	107.5	R829	R829-G831 PolarHBondContact O-N 3.04Å
832	S	35.7	Very low	37.8	Very low	111 Å²	111	148.1 Å²	148.1	78%	0.776	77%	0.774	S	S	*	*			cis	-153.3	-169.8	4.2	52.2	0	0	0	0	110.9	E834	S832-E834 PolarHBondContact O-N 3.24Å
833	K	37.8	Very low	38.2	Very low	164 Å²	164	141.8 Å²	141.8	71%	0.713	77%	0.772	S	S	*	*			trans	-24.9	119.2	137.6	-88.4	177.4	159	-86.2	0	110.7
834	E	31.9	Very low	37.9	Very low	139 Å²	139	140.2 Å²	140.2	65%	0.65	76%	0.761	S	S	*	*				105.7	177.8	80.7	-163.5	165	-145.5	0	0	108.5	S832	S832-E834 PolarHBondContact O-N 3.24Å
835	E	36.1	Very low	37.3	Very low	177 Å²	177	138.1 Å²	138.1	83%	0.827	74%	0.744	S	S	*	*			trans	56.7	66.4	168.9	-53.7	-144.1	142.6	0	0	118.5
836	A	35.6	Very low	37.7	Very low	85 Å²	85	133 Å²	133	70%	0.702	72%	0.721	S	S	*	*				42.9	118.2	122	0	0	0	0	0	120.1
837	K	40	Very low	37.5	Very low	201 Å²	201	124 Å²	124	87%	0.874	70%	0.695	S	S	*	*				-152.6	114.5	117.1	-109.3	131.2	-162.9	146.9	0	116.2
838	V	37.2	Very low	37.5	Very low	106 Å²	106	116.5 Å²	116.5	64%	0.642	66%	0.664	S	S	*	*			trans	66.7	92.5	131.8	-177.8	0	0	0	0	117.2
839	Q	38.5	Very low	37.5	Very low	156 Å²	156	115.2 Å²	115.2	73%	0.729	65%	0.648	S	S	*	*				45.8	124	118.8	-60.1	170.9	-7.1	0	0	118.7
840	A	37.4	Very low	37.5	Very low	94 Å²	94	106.3 Å²	106.3	78%	0.777	62%	0.618	S	S	*	*	S	Bend	trans	-80.7	113.2	130.3	0	0	0	0	0	108.9
841	K	41	Very low	37.9	Very low	171 Å²	171	105.4 Å²	105.4	74%	0.743	60%	0.595	S	S	*	*	S	Bend	trans	45.2	128.9	149.5	-57.8	173.9	-177.1	170.1	0	120.8
842	K	41.9	Very low	37.7	Very low	161 Å²	161	110.8 Å²	110.8	70%	0.7	59%	0.592	S	S	*	*			trans	48.1	118.1	139.9	-69.3	-166.7	171.6	-166.3	0	118.4
843	G	44.4	Very low	37.8	Very low	70 Å²	70	111.7 Å²	111.7	72%	0.722	59%	0.588	S	S	*	*			trans	-67.9	154.8	147.5	0	0	0	0	0	111.4
844	S	39.4	Very low	37.8	Very low	72 Å²	72	114.2 Å²	114.2	50%	0.503	59%	0.593	S	S	.	*			trans	-108.8	103.9	163.6	174.4	0	0	0	0	106.1	R298	R298-S844 PolarHBondContact O-OG 3.02Å
845	N	38	Very low	37.8	Very low	68 Å²	68	111.1 Å²	111.1	36%	0.364	59%	0.586	S	S	.	*				70.6	118.5	89.6	-56	-43.1	0	0	0	112.8	P294 A299	P294-N845 WeakPolarHBondContact CB-ND2 3.46Å; A299-N845 VanDerWaalsContact CA-CB 3.45Å; A299-N845 HydrophobicContact CB-CB 3.42Å; A299-N845 VanDerWaalsContact CB-CB 3.42Å
846	K	37.2	Very low	37.8	Very low	82 Å²	82	106.8 Å²	106.8	36%	0.357	57%	0.574	S	S	.	*			trans	169.1	152.7	155.8	-95.1	150.6	178.1	-152.1	0	110.5	R298 A299 L301	R298-K846 WeakPolarHBondContact O-CD 3.44Å; R298-K846 WeakPolarHBondContact O-CE 3.41Å; A299-K846 VanDerWaalsContact O-CA 3.3Å; A299-K846 WeakPolarHBondContact O-CA 3.29Å; L301-K846 VanDerWaalsContact C-CE 3.42Å; L301-K846 WeakPolarHBondContact O-CE 3.42Å; L301-K846 PolarHBondContact O-NZ 3.26Å
847	S	39.8	Very low	37.5	Very low	49 Å²	49	108.3 Å²	108.3	34%	0.343	57%	0.566	S	S	.	*			trans	68.1	136.3	-171.9	-34.6	0	0	0	0	113.2
848	D	33.8	Very low	37.8	Very low	31 Å²	31	104.8 Å²	104.8	17%	0.166	55%	0.551	C	S	.	*			cis	66.1	93.2	39.7	-61	6.5	0	0	0	112.3	T311 G312	T311-D848 CarbonylContact O-C 2.99Å; T311-D848 WeakPolarHBondContact O-CA 3.39Å; G312-D848 VanDerWaalsContact CA-CG 3.42Å; G312-D848 WeakPolarHBondContact CA-OD1 3.41Å
849	S	41.2	Very low	38.2	Very low	74 Å²	74	106 Å²	106	52%	0.517	56%	0.561	S	S	.	*			trans	-172.1	98.7	154.7	4.2	0	0	0	0	111.8	T311 Q318	T311-S849 PolarHBondContact O-N 3.12Å; Q318-S849 PolarHBondContact NE2-O 3.15Å
850	D	36.2	Very low	38.5	Very low	41 Å²	41	100.8 Å²	100.8	22%	0.219	55%	0.549	C	S	.	.				56.1	143	112.2	-133.7	9.8	0	0	0	123.4	T311 Q318	T311-D850 HydrophobicContact CG2-CB 4.19Å; T311-D850 PolarHBondContact O-N 3.04Å; Q318-D850 PolarHBondContact NE2-O 3.02Å
851	H	36.5	Very low	39	Very low	86 Å²	86	106.2 Å²	106.2	40%	0.398	56%	0.555	S	S	.	*			trans	61.2	117.8	146.5	-87.2	44.9	0	0	0	118.9	D314	D314-H851 PolarHBondContact OD2-N 3.49Å
852	R	32.1	Very low	38.8	Very low	188 Å²	188	104.6 Å²	104.6	71%	0.709	55%	0.553	S	S	*	*				57.3	111.8	90.6	-75	167.6	164.5	174.6	-1.2	110.8
853	L	37.4	Very low	39	Very low	131 Å²	131	105.8 Å²	105.8	69%	0.686	56%	0.562	S	S	*	*			cis	-164.3	-179.5	28.9	-96.2	147.1	0	0	0	110.9
854	R	38.8	Very low	38.8	Very low	216 Å²	216	107.4 Å²	107.4	82%	0.815	56%	0.562	S	S	*	*			trans	42.4	113.3	143.3	-75.8	170.4	172.5	149	-3	117.9
855	S	31.3	Very low	39.3	Very low	74 Å²	74	109 Å²	109	52%	0.517	57%	0.57	S	S	.	*			cis	47.8	133.3	33.8	-80.5	0	0	0	0	114.6	E369	E369-S855 WeakPolarHBondContact OE2-CB 3.3Å; E369-S855 PolarHBondContact OE2-OG 2.97Å
856	P	35.7	Very low	39.4	Very low	87 Å²	87	111.6 Å²	111.6	57%	0.565	59%	0.589	S	S	*	*			cis	-97.4	-167.7	-1.8	18.2	5.4	0	0	0	109.7	E369	E369-P856 HydrophobicContact CB-CB 4.37Å
857	E	29.2	Very low	39.5	Very low	117 Å²	117	115.4 Å²	115.4	55%	0.547	61%	0.612	S	S	.	*			cis	51.4	164.4	45.1	-58.5	-146.2	92.1	0	0	113.4	E370	E370-E857 HydrophobicContact CG-CB 4.39Å
858	K	46.3	Very low	39.5	Very low	127 Å²	127	116.6 Å²	116.6	55%	0.552	62%	0.617	S	S	*	*			trans	-90.3	-167	-158.3	-29.7	76.5	176.9	163.1	0	109.4	E370	E370-K858 VanDerWaalsContact CD-CD 3.48Å; E370-K858 VanDerWaalsContact CD-N 3.31Å; E370-K858 VanDerWaalsContact CG-O 3.27Å; E370-K858 WeakPolarHBondContact CG-O 2.98Å; E370-K858 WeakPolarHBondContact OE1-CD 3.4Å; E370-K858 PolarHBondContact OE1-N 3.26Å; E370-K858 IonicContact OE1-NZ 3.91Å; E370-K858 PolarHBondContact OE1-NZ 3.41Å; E370-K858 VanDerWaalsContact OE2-C 3.23Å; E370-K858 WeakPolarHBondContact OE2-CB 2.88Å; E370-K858 WeakPolarHBondContact OE2-CD 3.39Å
859	P	46.2	Very low	39.3	Very low	131 Å²	131	122.8 Å²	122.8	85%	0.851	64%	0.638	S	S	*	*			trans	-122.3	137.2	142.7	0.4	20.2	0	0	0	111.9
860	G	44.7	Very low	38.8	Very low	47 Å²	47	126.8 Å²	126.8	49%	0.485	65%	0.647	S	S	.	*			trans	-111.6	122.8	164.4	0	0	0	0	0	112.2	E370	E370-G860 PolarHBondContact OE2-N 2.79Å
861	K	47.2	Very low	38.8	Very low	208 Å²	208	130.4 Å²	130.4	90%	0.904	67%	0.666	S	S	*	*			trans	48.3	122.7	146.4	-58	179	178.5	-176.6	0	119.6
862	I	37.7	Very low	38.8	Very low	137 Å²	137	130.6 Å²	130.6	70%	0.703	68%	0.683	S	S	*	*			trans	-118.9	155.5	152.3	-62.5	177.3	0	0	0	108.9
863	Q	46.6	Very low	38.8	Very low	186 Å²	186	126.6 Å²	126.6	87%	0.869	68%	0.679	S	S	*	*			trans	-140.8	165	162.6	-132.7	177.4	13.8	0	0	110.9
864	S	38.9	Very low	38.9	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	67%	0.674	S	S	*	*			trans	-97.3	-161.6	-157.7	60.8	0	0	0	0	112.4
865	P	51.2	Low	39.1	Very low	105 Å²	105	118.5 Å²	118.5	68%	0.682	65%	0.649	S	S	*	*			cis	-143.5	-173.4	-0.1	32.9	-8.4	0	0	0	117.7
866	T	39.3	Very low	39.2	Very low	123 Å²	123	119.9 Å²	119.9	76%	0.755	65%	0.65	S	S	*	*			trans	91	110.2	148.1	-13.4	0	0	0	0	120.1
867	L	39.4	Very low	39.2	Very low	161 Å²	161	122 Å²	122	84%	0.843	65%	0.65	S	S	*	*				-168.4	-168.2	128.7	-108.2	170.7	0	0	0	111.2
868	T	39.2	Very low	39.5	Very low	74 Å²	74	122.5 Å²	122.5	45%	0.454	65%	0.652	S	S	.	*			trans	-132.4	148.6	-149.8	55.2	0	0	0	0	117.6	I527	I527-T868 HydrophobicContact CB-CG2 4.41Å
869	R	29.8	Very low	38.9	Very low	161 Å²	161	125 Å²	125	61%	0.608	67%	0.666	S	S	*	*			trans	85.6	129.7	141.1	-108.9	-176	177.2	-170.7	-6.4	121.3	I527 K528	I527-R869 WeakPolarHBondContact O-CD 3.33Å; K528-R869 PolarHBondContact O-NH1 2.83Å
870	K	32.3	Very low	38.3	Very low	159 Å²	159	122.7 Å²	122.7	69%	0.691	66%	0.658	S	S	*	*			trans	74.1	115.2	160.2	-61	-151.5	166.6	-166.9	0	116.4
871	D	34.4	Very low	37.7	Very low	116 Å²	116	127.6 Å²	127.6	62%	0.62	67%	0.672	S	S	*	*				63.9	105.1	71.3	-46.8	-37.4	0	0	0	109.1	K523	K523-D871 IonicContact NZ-OD1 2.63Å; K523-D871 PolarHBondContact NZ-OD1 3.01Å; K523-D871 IonicContact NZ-OD2 2.67Å
872	A	37	Very low	36.9	Very low	91 Å²	91	126 Å²	126	75%	0.752	67%	0.668	S	S	*	*			cis	-146.2	-164.5	0.5	0	0	0	0	0	108.3
873	T	33.4	Very low	36.6	Very low	104 Å²	104	126.5 Å²	126.5	64%	0.638	67%	0.667	S	S	*	*			cis	-150.2	-141.4	15.8	-36.7	0	0	0	0	110.3	L958	T873-L958 HydrophobicContact CG2-CD2 4.47Å
874	K	37.9	Very low	36.6	Very low	133 Å²	133	120.8 Å²	120.8	58%	0.578	65%	0.647	S	S	*	*			trans	-162	169.4	-179.7	-114.7	170	-172.2	175.1	0	107.8	L876 A955	K874-L876 HydrophobicContact CD-CD1 4.19Å; K874-L876 HydrophobicContact CG-CD1 4.38Å; K874-A955 HydrophobicContact CB-CB 3.51Å
875	P	43.2	Very low	36.5	Very low	43 Å²	43	124.8 Å²	124.8	28%	0.279	65%	0.653	S	S	.	*				-142.8	-172.8	52.7	40	-19	0	0	0	117.7	A955 F956 T959	P875-A955 WeakPolarHBondContact CB-O 3.29Å; P875-A955 WeakPolarHBondContact CG-O 3.21Å; P875-F956 HydrophobicContact CB-CB 4.47Å; P875-F956 HydrophobicContact CB-CD1 3.8Å; P875-F956 HydrophobicContact CB-CD2 3.88Å; P875-F956 HydrophobicContact CB-CE1 3.71Å; P875-F956 HydrophobicContact CB-CE2 3.79Å; P875-F956 HydrophobicContact CB-CG 3.87Å; P875-F956 HydrophobicContact CB-CZ 3.66Å; P875-F956 HydrophobicContact CG-CD1 4.21Å; P875-F956 HydrophobicContact CG-CE1 4.27Å; P875-F956 WeakPolarHBondContact CG-O 3.23Å; P875-T959 HydrophobicContact CG-CG2 4.44Å
876	L	33	Very low	35.8	Very low	103 Å²	103	124.6 Å²	124.6	54%	0.539	65%	0.651	S	S	.	*			trans	-102.1	-165.3	179.5	31.2	-44.8	0	0	0	112.6	K874 F956	K874-L876 HydrophobicContact CD-CD1 4.19Å; K874-L876 HydrophobicContact CG-CD1 4.38Å; L876-F956 VanDerWaalsContact C-CZ 3.41Å; L876-F956 HydrophobicContact CB-CZ 4.21Å; L876-F956 HydrophobicContact CD1-CE2 3.88Å; L876-F956 HydrophobicContact CD1-CZ 4.06Å; L876-F956 HydrophobicContact CD2-CE2 3.85Å; L876-F956 HydrophobicContact CD2-CZ 3.72Å; L876-F956 HydrophobicContact CG-CE2 4.3Å; L876-F956 HydrophobicContact CG-CZ 4.09Å; L876-F956 WeakPolarHBondContact O-CE1 3.21Å; L876-F956 WeakPolarHBondContact O-CZ 3.27Å
877	K	36.5	Very low	35.9	Very low	132 Å²	132	123.6 Å²	123.6	57%	0.574	65%	0.646	S	S	*	*				169.9	160.7	91.4	-117.5	-175.8	-172.5	-76.8	0	105.5	F956	K877-F956 HydrophobicContact CB-CE1 3.79Å; K877-F956 HydrophobicContact CB-CZ 3.79Å; K877-F956 HydrophobicContact CD-CD1 4.3Å; K877-F956 HydrophobicContact CD-CE1 3.63Å; K877-F956 HydrophobicContact CD-CE2 4.42Å; K877-F956 HydrophobicContact CD-CZ 3.74Å; K877-F956 HydrophobicContact CG-CE1 3.64Å; K877-F956 HydrophobicContact CG-CE2 4.18Å; K877-F956 HydrophobicContact CG-CZ 3.34Å
878	E	35.6	Very low	35.9	Very low	127 Å²	127	124.8 Å²	124.8	59%	0.593	65%	0.645	S	S	*	*			cis	-169.2	-177.5	-11.8	-150.3	158.9	-128.8	0	0	110.1
879	Q	34.1	Very low	35.9	Very low	180 Å²	180	127.4 Å²	127.4	84%	0.841	66%	0.656	S	S	*	*			trans	72.5	149.6	168.5	-56	-172.9	15.9	0	0	116.1
880	A	32.7	Very low	36.3	Very low	82 Å²	82	126.7 Å²	126.7	68%	0.678	66%	0.663	S	S	*	*			cis	-173.9	165.6	-16.2	0	0	0	0	0	108.5
881	L	33.5	Very low	36.6	Very low	151 Å²	151	126.6 Å²	126.6	79%	0.791	67%	0.67	S	S	*	*			cis	-167.2	175.3	-24.5	-108.2	172.2	0	0	0	109.6
882	Q	29.5	Very low	36.7	Very low	175 Å²	175	132.5 Å²	132.5	82%	0.818	68%	0.683	S	S	*	*			trans	66.3	159.5	162.3	-70.4	174.9	25.5	0	0	119.7
883	Q	32.2	Very low	36.4	Very low	147 Å²	147	133.6 Å²	133.6	69%	0.687	69%	0.685	S	S	*	*			cis	-153.7	-161.1	-46.2	-132.8	-152	2.4	0	0	111.8	K1013	Q883-K1013 PolarHBondContact NE2-O 2.99Å
884	P	45	Very low	37	Very low	66 Å²	66	134.6 Å²	134.6	43%	0.429	69%	0.693	S	S	.	*			trans	-129.2	-179.6	-135.5	45.1	-26.6	0	0	0	118.5
885	Q	37.8	Very low	37	Very low	187 Å²	187	140.1 Å²	140.1	87%	0.874	71%	0.711	S	S	*	*			trans	-175.7	-177.9	132.4	-101.8	-177.8	39.5	0	0	114.4
886	T	35.4	Very low	36.8	Very low	101 Å²	101	147.4 Å²	147.4	62%	0.62	74%	0.738	S	S	*	*			trans	-153.4	161.3	-171.8	61.6	0	0	0	0	112
887	P	41.6	Very low	37.5	Very low	102 Å²	102	150.5 Å²	150.5	66%	0.662	75%	0.754	S	S	*	*				-166.5	169.6	101.3	42.9	-22.4	0	0	0	120.3
888	K	40.8	Very low	37.4	Very low	186 Å²	186	148.5 Å²	148.5	81%	0.809	76%	0.757	S	S	*	*			trans	61.9	161.5	146.1	-72.5	161.1	-172.9	174.5	0	120.5
889	N	39.3	Very low	37.7	Very low	130 Å²	130	152.9 Å²	152.9	70%	0.695	77%	0.774	S	S	*	*			cis	-162.7	151	-35.3	-113.1	0.8	0	0	0	113.1
890	L	37.6	Very low	37.7	Very low	145 Å²	145	153.4 Å²	153.4	76%	0.759	78%	0.776	S	S	*	*			trans	35.9	123.5	144.4	-57.8	167.5	0	0	0	123.3
891	L	38.9	Very low	38	Very low	158 Å²	158	159.4 Å²	159.4	83%	0.827	79%	0.787	S	S	*	*				167.2	127.7	112.4	-94.7	158.9	0	0	0	117.7
892	R	35.3	Very low	38.3	Very low	240 Å²	240	159.4 Å²	159.4	91%	0.906	79%	0.788	S	S	*	*			trans	47.9	131.1	148.3	-101.3	175	175.7	163.2	-0.8	123.7
893	S	31.7	Very low	38.4	Very low	113 Å²	113	159.3 Å²	159.3	79%	0.79	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-99.8	156	-178.3	-30.5	0	0	0	0	115.5
894	P	46.1	Very low	38.5	Very low	125 Å²	125	162.8 Å²	162.8	81%	0.812	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.9	142.6	155.4	-11.9	28.4	0	0	0	111.8
895	R	37.9	Very low	37.8	Very low	250 Å²	250	164.9 Å²	164.9	94%	0.943	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-76.4	152.2	176.8	-87.9	178.3	163.9	172.1	-6.2	112.7
896	K	39.5	Very low	37.5	Very low	196 Å²	196	163.9 Å²	163.9	85%	0.852	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-88.6	139.8	170.4	-63.7	177	-178.3	174.7	0	111.3
897	L	46.5	Very low	37.5	Very low	167 Å²	167	168 Å²	168	87%	0.874	80%	0.801	S	S	*	*			trans	-133.7	123.2	147.2	-65	172.5	0	0	0	105.5
898	S	34.4	Very low	36.9	Very low	91 Å²	91	169.5 Å²	169.5	64%	0.636	80%	0.803	S	S	*	*			cis	79.8	77.6	29.9	89.9	0	0	0	0	115
899	K	42.3	Very low	36.4	Very low	218 Å²	218	165.7 Å²	165.7	95%	0.948	80%	0.795	S	S	*	*			trans	-173.6	77.1	150.3	-104.3	161.7	-174.5	178.9	0	111.7
900	E	32.9	Very low	35.9	Very low	192 Å²	192	164.4 Å²	164.4	90%	0.897	79%	0.792	S	S	*	*			trans	-121.1	106.4	152	-171.5	171.6	-164.4	0	0	106.2
901	K	40.4	Very low	35.8	Very low	207 Å²	207	165.4 Å²	165.4	90%	0.9	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-100.1	127.8	-176.6	-165	172.5	-176.9	178	0	108.6
902	N	38.7	Very low	35.4	Very low	152 Å²	152	161.7 Å²	161.7	81%	0.813	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-67.2	162.7	-165.6	-102.4	-48.4	0	0	0	114.9
903	Q	32.9	Very low	35.2	Very low	173 Å²	173	155.1 Å²	155.1	81%	0.808	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.2	145.6	-177.9	-62.2	-177.1	-52.3	0	0	112.9
904	R	33	Very low	35.2	Very low	220 Å²	220	158.1 Å²	158.1	83%	0.83	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.5	134.1	164.6	-93.6	-174.6	171.5	-176.1	-1.4	110.9
905	E	30.7	Very low	34.5	Very low	109 Å²	109	158 Å²	158	51%	0.509	77%	0.767	S	S	.	*				58.1	119.6	128.5	-62.2	-174.3	94.2	0	0	122.1
906	K	32.2	Very low	34.1	Very low	167 Å²	167	151.1 Å²	151.1	73%	0.726	76%	0.757	S	S	*	*				73.6	157.8	122.2	-66.3	174.6	179.5	157.8	0	119.8
907	K	34	Very low	33.7	Very low	187 Å²	187	148.1 Å²	148.1	81%	0.813	74%	0.744	S	S	*	*			trans	69.9	142.8	161.5	-72.9	174.6	178.3	-176.6	0	117.9
908	D	29.8	Very low	33	Very low	134 Å²	134	147.4 Å²	147.4	72%	0.717	73%	0.734	S	S	*	*			cis	-174.4	179.7	-32.9	-125.5	-53.4	0	0	0	109.9
909	V	30.8	Very low	33.1	Very low	106 Å²	106	146.2 Å²	146.2	64%	0.642	72%	0.72	S	S	*	*			trans	58	92.9	140.4	167.5	0	0	0	0	118.2
910	T	28.4	Very low	32.5	Very low	103 Å²	103	139.7 Å²	139.7	63%	0.632	70%	0.696	S	S	*	*				86.1	165.1	125.8	71.6	0	0	0	0	122.5
911	K	35	Very low	32.8	Very low	165 Å²	165	135.1 Å²	135.1	72%	0.717	69%	0.685	S	S	*	*			trans	74	135.8	172.4	-55.7	168.2	-169.1	178.1	0	111.4	R742	R742-K911 PolarHBondContact NH1-O 3.36Å; R742-K911 PolarHBondContact NH2-O 3.33Å
912	S	30.2	Very low	32.3	Very low	80 Å²	80	129 Å²	129	56%	0.559	68%	0.681	S	S	*	*			cis	-128.4	148.7	10.2	-59.6	0	0	0	0	111.4	R742	R742-S912 PolarHBondContact NH1-OG 2.68Å
913	P	30.9	Very low	31.9	Very low	103 Å²	103	125.1 Å²	125.1	67%	0.669	68%	0.677	S	S	*	*			trans	-77.9	159.6	172.6	34.3	-35.7	0	0	0	111.8	T915	P913-T915 HydrophobicContact CB-CG2 4.42Å
914	M	31.7	Very low	31.9	Very low	175 Å²	175	125 Å²	125	86%	0.862	68%	0.681	S	S	*	*			trans	-125.2	111.4	143	-65.6	-164	75.3	0	0	107.2
915	T	31.9	Very low	32.1	Very low	123 Å²	123	123.8 Å²	123.8	76%	0.755	68%	0.681	S	S	*	*			trans	-109.2	144.7	176	45.2	0	0	0	0	109.8	P913	P913-T915 HydrophobicContact CB-CG2 4.42Å
916	S	29.9	Very low	32	Very low	105 Å²	105	124.8 Å²	124.8	73%	0.734	70%	0.695	S	S	*	*			trans	-76.9	163.2	178.4	49.6	0	0	0	0	114
917	K	30.7	Very low	32.1	Very low	133 Å²	133	123 Å²	123	58%	0.578	70%	0.701	S	S	*	*			trans	170.4	124	152.8	-93.5	163.7	-178.6	-166.7	0	103.4	H232	H232-K917 PolarHBondContact NE2-NZ 2.8Å
918	K	33	Very low	32	Very low	152 Å²	152	123.7 Å²	123.7	66%	0.661	70%	0.704	S	S	*	*			cis	-108	-152.4	39.8	-65	-165.2	139.3	-71.3	0	115.1	A228	A228-K918 PolarHBondContact O-NZ 2.94Å
919	D	35.4	Very low	32.5	Very low	66 Å²	66	122 Å²	122	35%	0.353	71%	0.708	S	S	.	*				-157.4	-166.1	-81.6	-69.7	-23.9	0	0	0	108	A228 Q229 G230	A228-D919 VanDerWaalsContact O-OD2 3.06Å; Q229-D919 WeakPolarHBondContact CA-OD2 3.29Å; Q229-D919 WeakPolarHBondContact O-CB 3.27Å; G230-D919 WeakPolarHBondContact CA-OD1 3.5Å; G230-D919 PolarHBondContact N-OD1 2.93Å; G230-D919 VanDerWaalsContact N-OD1 3.11Å; G230-D919 PolarHBondContact N-OD2 3.3Å
920	N	30.6	Very low	32.5	Very low	82 Å²	82	126.4 Å²	126.4	44%	0.439	72%	0.719	S	S	.	*			cis	-160.7	161.6	15.4	173.8	45.6	0	0	0	116.9	A228 Q229	A228-N920 WeakPolarHBondContact CA-ND2 3.37Å; A228-N920 HydrophobicContact CB-CB 3.36Å; A228-N920 VanDerWaalsContact CB-CG 3.41Å; A228-N920 VanDerWaalsContact CB-ND2 3.32Å; A228-N920 WeakPolarHBondContact CB-ND2 3.11Å; Q229-N920 PolarHBondContact N-OD1 3.15Å; Q229-N920 WeakPolarHBondContact O-CA 3.32Å; Q229-N920 PolarHBondContact O-OD1 3.36Å
921	S	38.8	Very low	32.8	Very low	95 Å²	95	129.4 Å²	129.4	66%	0.664	73%	0.728	S	S	*	*			trans	104.1	137.9	143.3	75.9	0	0	0	0	120.7
922	G	29.5	Very low	32.5	Very low	79 Å²	79	129.6 Å²	129.6	81%	0.814	73%	0.731	S	S	*	*			trans	85.9	90.8	150.7	0	0	0	0	0	119.8
923	G	29.7	Very low	32.9	Very low	71 Å²	71	133.1 Å²	133.1	73%	0.732	74%	0.744	S	S	*	*				88	101.5	123.9	0	0	0	0	0	122.1
924	L	34	Very low	32.9	Very low	170 Å²	170	133.7 Å²	133.7	89%	0.89	75%	0.745	S	S	*	*				79.5	148.7	125.4	-74.8	164.8	0	0	0	123.7
925	K	36	Very low	32.8	Very low	194 Å²	194	134.2 Å²	134.2	84%	0.843	75%	0.746	S	S	*	*			trans	70.9	97	162.7	-70.3	176.1	-178.2	-179.3	0	119.2
926	T	29.1	Very low	32.7	Very low	130 Å²	130	133 Å²	133	80%	0.798	75%	0.748	S	S	*	*			trans	-68.4	162.3	152.6	49.1	0	0	0	0	111.5
927	P	35	Very low	32.9	Very low	130 Å²	130	130.9 Å²	130.9	84%	0.844	74%	0.742	S	S	*	*				-133.3	179.1	107.7	38.3	-30.4	0	0	0	114
928	K	30.6	Very low	33	Very low	202 Å²	202	132.3 Å²	132.3	88%	0.878	75%	0.748	S	S	*	*			trans	-109.6	128.6	-175.3	-60.7	170.8	-177.9	169.5	0	112.4
929	A	40.6	Very low	33.1	Very low	98 Å²	98	134.8 Å²	134.8	81%	0.81	75%	0.754	S	S	*	*			trans	-154.7	120.8	147.9	0	0	0	0	0	106.3
930	K	32.4	Very low	33.1	Very low	198 Å²	198	135.2 Å²	135.2	86%	0.861	76%	0.756	S	S	*	*			cis	72	128	46.7	-82	-158.8	169	-168.8	0	114.8
931	M	33.8	Very low	33.5	Very low	166 Å²	166	133.9 Å²	133.9	82%	0.818	76%	0.756	S	S	*	*			trans	63.9	124.9	177	-59.3	176.1	72.6	0	0	114.7
932	E	28.3	Very low	33.3	Very low	169 Å²	169	134.2 Å²	134.2	79%	0.79	76%	0.759	S	S	*	*			cis	81	98.9	37.7	-168.4	175.4	-163.2	0	0	113.6
933	N	39.8	Very low	33.2	Very low	155 Å²	155	138.4 Å²	138.4	83%	0.829	75%	0.75	S	S	*	*			trans	-151.4	146.8	130.1	-153.7	-20	0	0	0	109.8
934	V	29.1	Very low	33.7	Very low	114 Å²	114	140.4 Å²	140.4	69%	0.691	75%	0.753	S	S	*	*			trans	-149.8	103.2	-173.6	176.8	0	0	0	0	110.5
935	Q	30.5	Very low	33.9	Very low	187 Å²	187	136.5 Å²	136.5	87%	0.874	74%	0.738	S	S	*	*			trans	179.3	153.5	140.2	-105.1	162.4	80.8	0	0	117.7
936	A	29.7	Very low	33.9	Very low	97 Å²	97	131.5 Å²	131.5	80%	0.802	72%	0.723	S	S	*	*			trans	73	153.4	146	0	0	0	0	0	122.7
937	G	33.7	Very low	34	Very low	60 Å²	60	129.1 Å²	129.1	62%	0.619	70%	0.704	S	S	*	*			trans	77.3	128.4	-178.1	0	0	0	0	0	115.2
938	K	33.7	Very low	34.1	Very low	163 Å²	163	126 Å²	126	71%	0.709	69%	0.686	S	S	*	*			cis	75.8	127.9	-7.7	-78.4	-161.4	172	-167.8	0	117
939	R	34.9	Very low	34.5	Very low	205 Å²	205	125.7 Å²	125.7	77%	0.774	69%	0.685	S	S	*	*			trans	97.8	155.4	179.4	-60.7	-164.9	143.1	143	0.4	116.1	D176	D176-R939 PolarHBondContact OD2-N 3.03Å
940	D	35.7	Very low	34.4	Very low	74 Å²	74	129.9 Å²	129.9	40%	0.396	69%	0.69	S	S	.	*			cis	-149.3	159.7	-42.2	-81.8	-30.1	0	0	0	106.3	E177	E177-D940 HydrophobicContact CB-CB 3.89Å; E177-D940 VanDerWaalsContact CB-OD1 3.27Å; E177-D940 WeakPolarHBondContact CB-OD1 3.13Å; E177-D940 WeakPolarHBondContact CG-OD1 3.46Å
941	A	38.8	Very low	35.1	Very low	54 Å²	54	128 Å²	128	45%	0.446	69%	0.689	S	S	.	*			trans	-137	-171.9	179	0	0	0	0	0	114.9	D176 E177	D176-A941 WeakPolarHBondContact O-CB 3.18Å; D176-A941 PolarHBondContact O-N 3.08Å; E177-A941 CarbonylContact C-O 3.16Å; E177-A941 CarbonylContact O-C 3.53Å; E177-A941 VanDerWaalsContact O-C 3.25Å; E177-A941 VanDerWaalsContact O-O 3.09Å
942	S	33.3	Very low	35.5	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	69%	0.688	S	S	*	*			trans	-157.6	-170.1	170.3	66.2	0	0	0	0	113.5	I178	I178-S942 WeakPolarHBondContact O-CA 3.49Å; I178-S942 WeakPolarHBondContact O-CB 3.49Å
943	R	28.6	Very low	36.2	Very low	168 Å²	168	127.3 Å²	127.3	63%	0.634	69%	0.688	S	S	*	*			trans	-127.4	148.3	-144.5	-53.7	157.6	87.6	-179.5	8.5	116.5	G179	G179-R943 WeakPolarHBondContact O-CD 3.38Å; G179-R943 PolarHBondContact O-NH1 3.23Å
944	S	40.2	Very low	36.5	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	69%	0.689	S	S	*	*			trans	72.8	177.5	148.6	88.5	0	0	0	0	116.8
945	P	37.5	Very low	37.4	Very low	88 Å²	88	121.5 Å²	121.5	57%	0.571	67%	0.667	S	S	*	*			cis	-128.3	-164.8	19.5	42.7	-24.2	0	0	0	116.9	N997	P945-N997 WeakPolarHBondContact CB-ND2 3.22Å
946	V	35.8	Very low	37.9	Very low	89 Å²	89	115.7 Å²	115.7	54%	0.539	64%	0.639	S	S	.	*			trans	-142.3	145.4	-167.3	172.7	0	0	0	0	112	P524	P524-V946 HydrophobicContact CB-CG1 4.13Å; P524-V946 HydrophobicContact CB-CG2 4.19Å; P524-V946 HydrophobicContact CG-CG1 3.9Å
947	I	32.3	Very low	39.1	Very low	79 Å²	79	116.8 Å²	116.8	41%	0.405	63%	0.631	S	S	.	*			trans	-141.9	173	172.5	-46.7	174	0	0	0	110.5	K996	I947-K996 WeakPolarHBondContact CD1-O 3.47Å
948	S	36.8	Very low	39.9	Very low	66 Å²	66	118.5 Å²	118.5	46%	0.462	63%	0.626	S	S	.	*				-147.3	159.3	-128.7	57.3	0	0	0	0	119.2	N521	N521-S948 VanDerWaalsContact CB-C 3.46Å; N521-S948 VanDerWaalsContact CB-O 3.26Å; N521-S948 WeakPolarHBondContact CB-O 3.34Å; N521-S948 PolarHBondContact ND2-N 3.11Å; N521-S948 PolarHBondContact ND2-O 3.38Å
949	K	40	Very low	40.4	Very low	195 Å²	195	115.3 Å²	115.3	85%	0.848	62%	0.62	S	S	*	*			trans	60.2	136.7	152.6	-72.2	-171.6	175.5	-169.1	0	122.3
950	M	37.6	Very low	41.1	Very low	186 Å²	186	113.5 Å²	113.5	92%	0.916	62%	0.618	S	S	*	*			trans	-157.5	177.7	132.1	-140.8	-175.6	175.3	0	0	110.3
951	D	47.8	Very low	42	Very low	157 Å²	157	113.1 Å²	113.1	84%	0.84	63%	0.625	S	S	*	*			trans	-95.4	168.9	-152.7	-71.7	-63.5	0	0	0	119.1
952	E	40.6	Very low	42.5	Very low	172 Å²	172	117 Å²	117	80%	0.804	64%	0.637	S	S	*	*			trans	-99.3	137.2	173.9	-56.8	-173.1	124.7	0	0	112.2
953	N	43.4	Very low	43.1	Very low	149 Å²	149	119.7 Å²	119.7	80%	0.797	64%	0.64	S	S	*	*			trans	178.5	-20.8	142.4	-100.3	-28.6	0	0	0	114.9	A955	N953-A955 PolarHBondContact O-N 3.19Å
954	S	46.8	Very low	44.2	Very low	121 Å²	121	120.3 Å²	120.3	85%	0.846	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	9.7	-168.2	-167.6	0	0	0	0	117.6	F956	S954-F956 VanDerWaalsContact C-N 3.26Å; S954-F956 PolarHBondContact O-N 3.28Å
955	A	48	Very low	44.1	Very low	27 Å²	27	123.6 Å²	123.6	22%	0.223	65%	0.65	C	S	.	*	T	Hydrogen-bonded Turn	trans	-76.4	-8.1	-176	0	0	0	0	0	114.4	K874 P875 N953	K874-A955 HydrophobicContact CB-CB 3.51Å; P875-A955 WeakPolarHBondContact CB-O 3.29Å; P875-A955 WeakPolarHBondContact CG-O 3.21Å; N953-A955 PolarHBondContact O-N 3.19Å
956	F	41.5	Very low	44	Very low	64 Å²	64	125.6 Å²	125.6	28%	0.281	65%	0.65	S	S	.	*	S	Bend	trans	-79.3	-35.9	-160.3	-115.5	-76.6	0	0	0	117	P875 L876 K877 S954	P875-F956 HydrophobicContact CB-CB 4.47Å; P875-F956 HydrophobicContact CB-CD1 3.8Å; P875-F956 HydrophobicContact CB-CD2 3.88Å; P875-F956 HydrophobicContact CB-CE1 3.71Å; P875-F956 HydrophobicContact CB-CE2 3.79Å; P875-F956 HydrophobicContact CB-CG 3.87Å; P875-F956 HydrophobicContact CB-CZ 3.66Å; P875-F956 HydrophobicContact CG-CD1 4.21Å; P875-F956 HydrophobicContact CG-CE1 4.27Å; P875-F956 WeakPolarHBondContact CG-O 3.23Å; L876-F956 VanDerWaalsContact C-CZ 3.41Å; L876-F956 HydrophobicContact CB-CZ 4.21Å; L876-F956 HydrophobicContact CD1-CE2 3.88Å; L876-F956 HydrophobicContact CD1-CZ 4.06Å; L876-F956 HydrophobicContact CD2-CE2 3.85Å; L876-F956 HydrophobicContact CD2-CZ 3.72Å; L876-F956 HydrophobicContact CG-CE2 4.3Å; L876-F956 HydrophobicContact CG-CZ 4.09Å; L876-F956 WeakPolarHBondContact O-CE1 3.21Å; L876-F956 WeakPolarHBondContact O-CZ 3.27Å; K877-F956 HydrophobicContact CB-CE1 3.79Å; K877-F956 HydrophobicContact CB-CZ 3.79Å; K877-F956 HydrophobicContact CD-CD1 4.3Å; K877-F956 HydrophobicContact CD-CE1 3.63Å; K877-F956 HydrophobicContact CD-CE2 4.42Å; K877-F956 HydrophobicContact CD-CZ 3.74Å; K877-F956 HydrophobicContact CG-CE1 3.64Å; K877-F956 HydrophobicContact CG-CE2 4.18Å; K877-F956 HydrophobicContact CG-CZ 3.34Å; S954-F956 VanDerWaalsContact C-N 3.26Å; S954-F956 PolarHBondContact O-N 3.28Å
957	D	53.5	Low	43.9	Very low	121 Å²	121	127.9 Å²	127.9	65%	0.647	65%	0.653	S	S	*	*	S	Bend	trans	-94	-6.8	-174.5	-65.4	-76.8	0	0	0	114	T959 K960	D957-T959 VanDerWaalsContact C-N 3.3Å; D957-T959 PolarHBondContact O-N 2.95Å; D957-K960 VanDerWaalsContact O-CB 3.29Å; D957-K960 WeakPolarHBondContact O-CB 3.39Å; D957-K960 PolarHBondContact O-N 3.13Å
958	L	51.2	Low	44.3	Very low	95 Å²	95	128.6 Å²	128.6	50%	0.497	66%	0.66	S	S	.	*	H	α-helix	trans	-67.3	-28.6	-170.6	-145.8	82.7	0	0	0	113.5	T873 K960 A961 I962	T873-L958 HydrophobicContact CG2-CD2 4.47Å; L958-K960 PolarHBondContact O-N 3.26Å; L958-A961 PolarHBondContact O-N 3.34Å; L958-I962 WeakPolarHBondContact O-CG1 3.44Å
959	T	45.3	Very low	43.9	Very low	96 Å²	96	128.8 Å²	128.8	59%	0.589	66%	0.659	S	S	*	*	H	α-helix	trans	-68	-18.9	172.6	38	0	0	0	0	113.3	P875 D957	P875-T959 HydrophobicContact CG-CG2 4.44Å; D957-T959 VanDerWaalsContact C-N 3.3Å; D957-T959 PolarHBondContact O-N 2.95Å
960	K	49.5	Very low	43.8	Very low	167 Å²	167	128.7 Å²	128.7	73%	0.726	66%	0.659	S	S	*	*	H	α-helix	trans	-84	-32.3	177.8	-157.7	176.3	-176.9	-177.7	0	112.3	D957 L958	D957-K960 VanDerWaalsContact O-CB 3.29Å; D957-K960 WeakPolarHBondContact O-CB 3.39Å; D957-K960 PolarHBondContact O-N 3.13Å; L958-K960 PolarHBondContact O-N 3.26Å
961	A	53.5	Low	43.6	Very low	66 Å²	66	128.4 Å²	128.4	55%	0.545	65%	0.652	S	S	.	*	H	α-helix	trans	-77.5	-26.2	-175.5	0	0	0	0	0	114.6	L958 M963 E964	L958-A961 PolarHBondContact O-N 3.34Å; A961-M963 PolarHBondContact O-N 3.28Å; A961-M963 VanDerWaalsContact O-N 3.14Å; A961-E964 PolarHBondContact O-N 3.43Å
962	I	49.3	Very low	43	Very low	136 Å²	136	127.3 Å²	127.3	70%	0.697	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-4.2	-171.9	-67.1	169.8	0	0	0	113.3	L958	L958-I962 WeakPolarHBondContact O-CG1 3.44Å
963	M	46.7	Very low	42.6	Very low	158 Å²	158	125.4 Å²	125.4	78%	0.778	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-9.5	174.9	-66.2	-153.8	-59.3	0	0	115.1	A961	A961-M963 PolarHBondContact O-N 3.28Å; A961-M963 VanDerWaalsContact O-N 3.14Å
964	E	52	Low	42.1	Very low	182 Å²	182	122.2 Å²	122.2	85%	0.85	65%	0.649	S	S	*	*			trans	-90.1	163.2	176.3	-70.8	-155.3	103	0	0	114	A961	A961-E964 PolarHBondContact O-N 3.43Å
965	K	37.7	Very low	41.5	Very low	181 Å²	181	126.4 Å²	126.4	79%	0.787	65%	0.652	S	S	*	*			trans	-128.6	134.9	-142.6	-72.2	171.4	-178.2	164.5	0	115.9
966	K	35.8	Very low	40.6	Very low	131 Å²	131	132.2 Å²	132.2	57%	0.57	68%	0.679	S	S	*	*			trans	66.4	140.7	137.8	-68.7	-170.5	-179.6	-162.3	0	121.4	G507	G507-K966 PolarHBondContact O-NZ 3.45Å
967	K	33.7	Very low	40.2	Very low	137 Å²	137	135.2 Å²	135.2	60%	0.596	70%	0.704	S	S	*	*			trans	71.8	141	159.2	-61.6	164.2	176.2	-172.4	0	116	T508 G509 Q510	T508-K967 WeakPolarHBondContact O-CE 3.38Å; G509-K967 WeakPolarHBondContact O-CA 3.27Å; G509-K967 WeakPolarHBondContact O-CG 3.32Å; G509-K967 PolarHBondContact O-N 2.84Å; G509-K967 VanDerWaalsContact O-N 3.1Å; Q510-K967 CarbonylContact O-C 3.41Å; Q510-K967 WeakPolarHBondContact O-CA 3.35Å
968	T	39.9	Very low	39.1	Very low	93 Å²	93	134.4 Å²	134.4	57%	0.571	70%	0.703	S	S	*	*			cis	-151.4	140.3	43.8	41.6	0	0	0	0	117.2	Q510 T511	Q510-T968 CarbonylContact O-C 3.53Å; Q510-T968 VanDerWaalsContact O-CA 3.24Å; Q510-T968 WeakPolarHBondContact O-CA 3.09Å; Q510-T968 PolarHBondContact O-N 3.25Å; T511-T968 CarbonylContact O-C 3.49Å; T511-T968 PolarHBondContact O-N 3.27Å
969	T	29.1	Very low	37.9	Very low	70 Å²	70	137.3 Å²	137.3	43%	0.429	72%	0.718	S	S	.	*			trans	-54.8	139.8	171	-52.4	0	0	0	0	116.6	Q510	Q510-T969 VanDerWaalsContact CB-OG1 3.23Å; Q510-T969 WeakPolarHBondContact CB-OG1 2.95Å; Q510-T969 PolarHBondContact OE1-OG1 3.35Å
970	K	37.7	Very low	37.3	Very low	193 Å²	193	138 Å²	138	84%	0.839	73%	0.727	S	S	*	*			trans	174.4	170.7	147	-97.3	151.7	-175	179.9	0	111
971	K	32.3	Very low	36.2	Very low	181 Å²	181	139.8 Å²	139.8	79%	0.787	73%	0.734	S	S	*	*				-164.1	169.4	-68.2	-141.4	-172.7	-178.7	-172.7	0	107.9
972	N	36.1	Very low	35.1	Very low	134 Å²	134	142.4 Å²	142.4	72%	0.717	75%	0.749	S	S	*	*			trans	71.2	132.2	175.5	-59.8	9.3	0	0	0	115.1
973	T	32.6	Very low	34	Very low	132 Å²	132	144.7 Å²	144.7	81%	0.81	76%	0.756	S	S	*	*			cis	87.2	109	32.2	69.3	0	0	0	0	115.4
974	G	32.9	Very low	33.3	Very low	82 Å²	82	146.8 Å²	146.8	85%	0.845	76%	0.764	S	S	*	*			trans	-176.7	124	173.8	0	0	0	0	0	113.3
975	K	33.3	Very low	32.2	Very low	209 Å²	209	142 Å²	142	91%	0.909	76%	0.764	S	S	*	*			trans	-62.5	162.1	-165	-61	170.3	177	177	0	117
976	L	29.1	Very low	31.7	Very low	149 Å²	149	138.2 Å²	138.2	78%	0.78	76%	0.761	S	S	*	*			trans	-60.3	155.8	159.3	-69.6	164.3	0	0	0	112	V978	L976-V978 HydrophobicContact CB-CG2 4.48Å; L976-V978 HydrophobicContact CD1-CG2 4.44Å; L976-V978 HydrophobicContact CD2-CG2 4.43Å
977	P	33	Very low	31.2	Very low	126 Å²	126	140.8 Å²	140.8	82%	0.818	77%	0.772	S	S	*	*				-119.9	163.7	122.4	35.7	-33.6	0	0	0	112.8
978	V	29.4	Very low	31.1	Very low	104 Å²	104	143 Å²	143	63%	0.63	78%	0.782	S	S	*	*			trans	-144.9	142.4	-172.8	163.3	0	0	0	0	108.6	L976	L976-V978 HydrophobicContact CB-CG2 4.48Å; L976-V978 HydrophobicContact CD1-CG2 4.44Å; L976-V978 HydrophobicContact CD2-CG2 4.43Å
979	I	27	Very low	30.5	Very low	157 Å²	157	148.6 Å²	148.6	81%	0.805	80%	0.798	S	S	*	*			trans	69.3	147.3	-177.8	-65	156	0	0	0	111.3
980	S	31.5	Very low	30.9	Very low	110 Å²	110	150.4 Å²	150.4	77%	0.769	82%	0.82	S	S	*	*			cis	-126.6	174.7	13.2	-27.2	0	0	0	0	114
981	K	27.5	Very low	30.4	Very low	204 Å²	204	144.4 Å²	144.4	89%	0.887	81%	0.813	S	S	*	*			trans	-85.8	154.5	156.2	-56.6	172.7	-176.9	174.5	0	109.8
982	S	30.7	Very low	30.3	Very low	121 Å²	121	142.5 Å²	142.5	85%	0.846	82%	0.816	S	S	*	*			trans	-131.7	158	152.9	60.5	0	0	0	0	109
983	E	26.3	Very low	30.4	Very low	184 Å²	184	141.6 Å²	141.6	86%	0.86	82%	0.818	S	S	*	*			trans	-97	176.1	-178.3	-65.6	177.9	104.2	0	0	111.9
984	E	31	Very low	30	Very low	202 Å²	202	144.5 Å²	144.5	94%	0.944	82%	0.819	S	S	*	*			trans	55.7	131.4	164.2	-59.6	-167.5	124.3	0	0	119.8
985	G	30.1	Very low	30	Very low	83 Å²	83	148 Å²	148	86%	0.856	81%	0.814	S	S	*	*			trans	163.9	71.4	-175.5	0	0	0	0	0	111.5
986	S	26	Very low	30	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	80%	0.8	S	S	*	*			trans	-86.7	170.8	-179.1	58.4	0	0	0	0	112.8
987	F	26.6	Very low	30.1	Very low	184 Å²	184	141.5 Å²	141.5	81%	0.807	78%	0.783	S	S	*	*			trans	88.6	142.3	170.3	-72.4	-82.3	0	0	0	121.6
988	K	30.3	Very low	30.6	Very low	185 Å²	185	141.1 Å²	141.1	80%	0.804	78%	0.78	S	S	*	*			trans	80.1	79.9	151	-71.4	158.3	-173.7	176.4	0	120.6
989	K	28.9	Very low	30.8	Very low	209 Å²	209	144.6 Å²	144.6	91%	0.909	79%	0.787	S	S	*	*				68.9	75.1	108	-162.3	-179.1	-176.6	-177.5	0	118.7
990	A	36.1	Very low	31.8	Very low	108 Å²	108	145 Å²	145	89%	0.893	79%	0.785	S	S	*	*			trans	-146.7	156.7	144.6	0	0	0	0	0	108.3
991	G	27.1	Very low	32.2	Very low	67 Å²	67	147.2 Å²	147.2	69%	0.691	78%	0.781	S	S	*	*			cis	164.8	56.2	0.3	0	0	0	0	0	114.7
992	V	30.1	Very low	33.4	Very low	141 Å²	141	148.1 Å²	148.1	86%	0.855	78%	0.779	S	S	*	*			trans	69.2	140.4	149.6	172.3	0	0	0	0	118.4
993	P	38	Very low	34.2	Very low	115 Å²	115	145.7 Å²	145.7	75%	0.747	76%	0.757	S	S	*	*			cis	-133.7	-163.4	-37.2	40.3	-20.5	0	0	0	112.5
994	K	25.8	Very low	36	Very low	194 Å²	194	142.1 Å²	142.1	84%	0.843	74%	0.742	S	S	*	*			trans	-103.5	153.1	156.5	-61.6	171.9	-178.9	171.7	0	109.1
995	E	31.4	Very low	37.5	Very low	156 Å²	156	134.5 Å²	134.5	73%	0.729	71%	0.71	S	S	*	*			trans	153.1	164.3	157.4	-90.1	-173.8	156.2	0	0	109.5
996	K	34.2	Very low	38.7	Very low	142 Å²	142	136.5 Å²	136.5	62%	0.617	70%	0.695	S	S	*	*			cis	-151.1	164.9	-2.8	-128.9	158.1	-172.8	145.4	0	110.6	I947	I947-K996 WeakPolarHBondContact CD1-O 3.47Å
997	N	30	Very low	40.7	Very low	79 Å²	79	137.5 Å²	137.5	42%	0.422	69%	0.692	S	S	.	*			trans	-51.9	166.6	169.6	-110.8	-61.1	0	0	0	113.5	P945	P945-N997 WeakPolarHBondContact CB-ND2 3.22Å
998	P	45.3	Very low	43	Very low	117 Å²	117	132.3 Å²	132.3	76%	0.76	67%	0.673	S	S	*	*				-151.6	179	55.3	42.1	-20.4	0	0	0	120
999	K	33	Very low	45	Very low	177 Å²	177	128.9 Å²	128.9	77%	0.77	66%	0.662	S	S	*	*			trans	-75.3	155	171.4	-40.1	150.3	-175.3	166.9	0	111.1
1000	E	47.7	Very low	47	Very low	167 Å²	167	121.9 Å²	121.9	78%	0.78	64%	0.644	S	S	*	*				-151.3	156.1	127.5	-141.3	-170.8	-163.9	0	0	111.5
1001	K	40	Very low	48.8	Very low	155 Å²	155	125.3 Å²	125.3	67%	0.674	64%	0.639	S	S	*	*			trans	-109.4	137.6	173.9	-57.6	170.5	-173.4	165.4	0	108.3
1002	R	53	Low	50.6	Low	223 Å²	223	132.7 Å²	132.7	84%	0.842	65%	0.646	S	S	*	*			trans	-120.7	146.2	156.4	-74.1	-170.3	-179.9	-176.9	-0.2	109.5
1003	N	48.2	Very low	52.3	Low	71 Å²	71	133.7 Å²	133.7	38%	0.38	64%	0.639	S	S	.	*			trans	-146.5	108.2	-151.7	-114.5	-11.4	0	0	0	105.8	M186 K187	M186-N1003 VanDerWaalsContact C-ND2 3.32Å; M186-N1003 WeakPolarHBondContact O-CB 3.46Å; M186-N1003 PolarHBondContact O-ND2 2.94Å; K187-N1003 HydrophobicContact CB-CB 3.84Å; K187-N1003 CarbonylContact O-C 3.56Å; K187-N1003 WeakPolarHBondContact O-CA 3.4Å; K187-N1003 WeakPolarHBondContact O-CB 3.06Å; K187-N1003 PolarHBondContact O-OD1 2.96Å
1004	I	64.1	Low	53	Low	108 Å²	108	134.7 Å²	134.7	55%	0.554	63%	0.633	S	S	*	*			trans	-105.6	109.7	-150.4	-62.3	179.5	0	0	0	110.3	K187 D1008	K187-I1004 PolarHBondContact O-N 3.39Å; I1004-D1008 HydrophobicContact CG2-CB 3.61Å
1005	T	61.2	Low	54.4	Low	43 Å²	43	131.5 Å²	131.5	26%	0.264	62%	0.622	S	S	.	*			trans	-76	160.7	-168.2	62.9	0	0	0	0	113.3	K187 N1007 D1008	K187-T1005 HydrophobicContact CB-CG2 4.24Å; K187-T1005 HydrophobicContact CD-CG2 3.56Å; K187-T1005 HydrophobicContact CG-CG2 3.93Å; T1005-N1007 PolarHBondContact O-N 3.38Å; T1005-D1008 PolarHBondContact N-OD2 2.89Å; T1005-D1008 VanDerWaalsContact N-OD2 3.11Å; T1005-D1008 WeakPolarHBondContact O-CB 3.25Å; T1005-D1008 PolarHBondContact O-N 3.37Å; T1005-D1008 PolarHBondContact OG1-OD2 3.5Å; T1005-D1008 VanDerWaalsContact OG1-OD2 3.08Å
1006	K	54.9	Low	55.7	Low	124 Å²	124	130.2 Å²	130.2	54%	0.539	62%	0.616	S	S	.	*	H	α-helix	trans	-56.4	-17.9	-179.2	-69.7	158.6	-179.4	146.4	0	114.9	E188 A1010	E188-K1006 IonicContact OE1-NZ 3.64Å; E188-K1006 PolarHBondContact OE1-NZ 3.38Å; E188-K1006 IonicContact OE2-NZ 2.6Å; E188-K1006 PolarHBondContact OE2-NZ 3.45Å; K1006-A1010 PolarHBondContact O-N 3.15Å
1007	N	68.5	Low	56.9	Low	122 Å²	122	129.5 Å²	129.5	65%	0.652	62%	0.616	S	S	*	*	H	α-helix	trans	-72.2	-33.3	171.9	-79.6	3.5	0	0	0	113.1	T1005 L1009 A1010 K1011	T1005-N1007 PolarHBondContact O-N 3.38Å; N1007-L1009 PolarHBondContact O-N 2.86Å; N1007-A1010 WeakPolarHBondContact O-CB 3.42Å; N1007-A1010 PolarHBondContact O-N 3.32Å; N1007-A1010 VanDerWaalsContact O-N 3.12Å; N1007-K1011 PolarHBondContact O-N 3.1Å; N1007-K1011 VanDerWaalsContact O-N 3.1Å
1008	D	76	Confident	58.6	Low	75 Å²	75	132.6 Å²	132.6	40%	0.401	63%	0.628	S	S	.	*	H	α-helix	trans	-71	-26.3	179.1	-55.2	-58.2	0	0	0	111.3	I1004 T1005	I1004-D1008 HydrophobicContact CG2-CB 3.61Å; T1005-D1008 PolarHBondContact N-OD2 2.89Å; T1005-D1008 VanDerWaalsContact N-OD2 3.11Å; T1005-D1008 WeakPolarHBondContact O-CB 3.25Å; T1005-D1008 PolarHBondContact O-N 3.37Å; T1005-D1008 PolarHBondContact OG1-OD2 3.5Å; T1005-D1008 VanDerWaalsContact OG1-OD2 3.08Å
1009	L	71.4	Confident	59.5	Low	113 Å²	113	133.7 Å²	133.7	59%	0.592	62%	0.62	S	S	*	*	H	α-helix	trans	-75.8	-30.2	170.3	-154.8	75.6	0	0	0	112.4	N1007 R1012	N1007-L1009 PolarHBondContact O-N 2.86Å; L1009-R1012 PolarHBondContact O-N 2.92Å
1010	A	70.4	Confident	61.4	Low	63 Å²	63	130.6 Å²	130.6	52%	0.521	61%	0.609	S	S	.	*	H	α-helix	trans	-71.9	-35.1	175.8	0	0	0	0	0	112.2	K1006 N1007 R1012 K1013	K1006-A1010 PolarHBondContact O-N 3.15Å; N1007-A1010 WeakPolarHBondContact O-CB 3.42Å; N1007-A1010 PolarHBondContact O-N 3.32Å; N1007-A1010 VanDerWaalsContact O-N 3.12Å; A1010-R1012 PolarHBondContact O-N 3.43Å; A1010-K1013 PolarHBondContact O-N 2.79Å
1011	K	74.1	Confident	62.5	Low	180 Å²	180	127.8 Å²	127.8	78%	0.783	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-1.4	173.3	-69.9	-175.8	175.2	-176	0	114.9	N1007	N1007-K1011 PolarHBondContact O-N 3.1Å; N1007-K1011 VanDerWaalsContact O-N 3.1Å
1012	R	66.2	Low	64.3	Low	221 Å²	221	125.5 Å²	125.5	83%	0.834	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	7	173.1	-81.6	-176	165.3	-170.4	-4.2	113	L1009 A1010	L1009-R1012 PolarHBondContact O-N 2.92Å; A1010-R1012 PolarHBondContact O-N 3.43Å
1013	K	64.2	Low	65.4	Low	163 Å²	163	116.6 Å²	116.6	71%	0.709	57%	0.566	S	S	*	*			trans	-108.2	0	162.4	-73.3	-168	174.5	-169.8	0	109.3	Q883 A1010	Q883-K1013 PolarHBondContact NE2-O 2.99Å; A1010-K1013 PolarHBondContact O-N 2.79Å

Retrieved 1,013 of 1,013 residues in 375 ms (Link to these results)

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