A0A3Q0KF95_SCHMA Loading...

Homeobox protein prospero/prox-1/ceh-26,putative

AlphaFold DB , UniProt , Accession A0A3Q0KF95, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 522 aa.

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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	40.1	Very low	36.1	Very low	225 Å²	225	162.7 Å²	162.7	100%	1.108	79%	0.788	S	S	*	*				0	65.6	0	-77.3	173.6	141.8	0	0	106.4
2	E	35.8	Very low	36.1	Very low	165 Å²	165	163.1 Å²	163.1	77%	0.771	79%	0.788	S	S	*	*				87.4	94.5	84.2	-80.6	162.2	148.8	0	0	109
3	S	32.9	Very low	35.6	Very low	96 Å²	96	160.2 Å²	160.2	67%	0.671	79%	0.786	S	S	*	*				90.6	143.7	75.8	-68.5	0	0	0	0	111.3
4	Y	38.9	Very low	35.8	Very low	220 Å²	220	157.6 Å²	157.6	86%	0.863	79%	0.788	S	S	*	*			trans	85.1	135.6	169.2	-57.4	-82.3	0	0	0	116.8
5	S	40.5	Very low	35.7	Very low	100 Å²	100	158.9 Å²	158.9	70%	0.699	79%	0.79	S	S	*	*			cis	-178.2	139.5	-23.2	-99.3	0	0	0	0	103.3
6	E	35.5	Very low	35.8	Very low	188 Å²	188	162.8 Å²	162.8	88%	0.879	80%	0.795	S	S	*	*			trans	-63.1	135.9	168.5	-64.4	173.6	148	0	0	109.7
7	D	40.7	Very low	35.9	Very low	144 Å²	144	162.6 Å²	162.6	77%	0.77	80%	0.798	S	S	*	*			trans	-155.1	112.1	155.8	-96.2	-31.2	0	0	0	111.3
8	E	35.1	Very low	35.7	Very low	120 Å²	120	164.8 Å²	164.8	56%	0.561	80%	0.802	S	S	*	*				59.3	115.8	128	-69.6	-151.9	122.6	0	0	122.8
9	R	32.8	Very low	35.8	Very low	184 Å²	184	162.7 Å²	162.7	69%	0.694	80%	0.802	S	S	*	*				82.3	124.3	123	-67.1	-172	-58.4	-143.6	5.3	119.9
10	N	30	Very low	35.5	Very low	132 Å²	132	165.3 Å²	165.3	71%	0.706	80%	0.803	S	S	*	*			trans	63.9	117.9	143.3	-65.2	-24.5	0	0	0	117.3
11	F	35.2	Very low	35.6	Very low	216 Å²	216	167.6 Å²	167.6	95%	0.947	81%	0.809	S	S	*	*			trans	-164.3	103	131.9	-99.8	-68.5	0	0	0	112.3
12	Q	35.4	Very low	35.1	Very low	167 Å²	167	163.8 Å²	163.8	78%	0.78	79%	0.793	S	S	*	*			trans	14.5	129	139.5	-130.7	70.8	3.2	0	0	121.4
13	T	30.4	Very low	34.9	Very low	126 Å²	126	159.1 Å²	159.1	77%	0.773	79%	0.79	S	S	*	*			trans	-65.2	150.5	159.5	47	0	0	0	0	113.7
14	P	38.5	Very low	35.1	Very low	124 Å²	124	163.2 Å²	163.2	81%	0.805	80%	0.803	S	S	*	*			trans	-112.3	116.9	161	32.1	-18.5	0	0	0	112.9
15	E	33.2	Very low	34.6	Very low	176 Å²	176	162.3 Å²	162.3	82%	0.822	81%	0.807	S	S	*	*			trans	-71.4	150.3	146.3	-80.7	-157.4	147.6	0	0	108.7
16	Y	37.3	Very low	34.1	Very low	222 Å²	222	160.5 Å²	160.5	87%	0.871	80%	0.804	S	S	*	*			trans	-174.6	134.2	140.1	-102.6	-62.4	0	0	0	113.6
17	L	37.2	Very low	34.1	Very low	160 Å²	160	160.3 Å²	160.3	84%	0.838	80%	0.8	S	S	*	*			trans	103.3	96.1	147.5	-61.3	161.9	0	0	0	121
18	K	32.5	Very low	33.5	Very low	202 Å²	202	163.1 Å²	163.1	88%	0.878	80%	0.801	S	S	*	*			trans	-93.7	149.8	146.1	-103.3	177.9	178.3	172.3	0	109.6
19	P	37.5	Very low	33.6	Very low	124 Å²	124	164.6 Å²	164.6	81%	0.805	81%	0.812	S	S	*	*			trans	-112	134	149.7	14.6	4.8	0	0	0	111.9
20	R	30.4	Very low	33.5	Very low	215 Å²	215	163.9 Å²	163.9	81%	0.811	82%	0.816	S	S	*	*			trans	-81.8	143.9	165.4	-74.8	179.9	169.2	175.1	-3.2	109.5
21	F	37.7	Very low	33.6	Very low	213 Å²	213	162 Å²	162	93%	0.934	81%	0.813	S	S	*	*			trans	-137.8	119	147.5	-105.3	-83.7	0	0	0	109.7
22	N	30.7	Very low	33.5	Very low	145 Å²	145	157.4 Å²	157.4	78%	0.775	80%	0.803	S	S	*	*			trans	-87.8	155.9	171.6	-75.4	-15.2	0	0	0	109.7
23	G	30.8	Very low	33.3	Very low	68 Å²	68	155.8 Å²	155.8	70%	0.701	81%	0.807	S	S	*	*			trans	119	104.4	150.5	0	0	0	0	0	114.3
24	L	36.6	Very low	33.4	Very low	181 Å²	181	157.4 Å²	157.4	95%	0.948	81%	0.81	S	S	*	*				173.5	99.4	116.8	-87.6	163.5	0	0	0	108.8
25	E	28.4	Very low	33	Very low	201 Å²	201	155.5 Å²	155.5	94%	0.939	80%	0.8	S	S	*	*			trans	-82.9	136.2	167.7	-168.5	178.1	-147.9	0	0	108
26	G	31.3	Very low	32.8	Very low	62 Å²	62	155.3 Å²	155.3	64%	0.639	80%	0.799	S	S	*	*			trans	153.7	108.1	161.6	0	0	0	0	0	117.7
27	K	34.4	Very low	32.6	Very low	185 Å²	185	150.1 Å²	150.1	80%	0.804	80%	0.795	S	S	*	*				90.4	106.5	118.2	-75.9	-169.8	-177.4	-179.8	0	120.1
28	Y	29.1	Very low	32.2	Very low	202 Å²	202	149.2 Å²	149.2	79%	0.792	79%	0.791	S	S	*	*			trans	64.3	147.1	144.5	-60.6	-89.1	0	0	0	115.7
29	I	36.4	Very low	32.2	Very low	152 Å²	152	144.9 Å²	144.9	78%	0.779	78%	0.783	S	S	*	*			cis	-164.8	123.4	47	-60.8	162.4	0	0	0	108.6
30	H	30.8	Very low	31.9	Very low	168 Å²	168	149.4 Å²	149.4	78%	0.778	79%	0.786	S	S	*	*			trans	29.8	123.1	130.5	-101.1	-86.8	0	0	0	121.5
31	S	31.1	Very low	32	Very low	93 Å²	93	144.1 Å²	144.1	65%	0.65	78%	0.782	S	S	*	*				154.7	122.4	104.2	-65.5	0	0	0	0	115.9
32	T	33.8	Very low	31.6	Very low	119 Å²	119	139.5 Å²	139.5	73%	0.73	77%	0.771	S	S	*	*			trans	60.9	136.2	144.4	43.6	0	0	0	0	122.9
33	P	30.3	Very low	31.7	Very low	134 Å²	134	141.2 Å²	141.2	87%	0.87	77%	0.772	S	S	*	*				-124.8	128.7	127	33.6	-23	0	0	0	112.2
34	L	34.1	Very low	31.7	Very low	159 Å²	159	145.3 Å²	145.3	83%	0.832	77%	0.772	S	S	*	*			trans	-76.6	135.9	168.4	-103.6	93.9	0	0	0	111
35	S	30	Very low	31.4	Very low	85 Å²	85	142.6 Å²	142.6	59%	0.594	77%	0.766	S	S	*	*			trans	-62.1	149.5	162.9	55.1	0	0	0	0	113.9
36	Q	29.5	Very low	31.6	Very low	172 Å²	172	140.4 Å²	140.4	80%	0.804	76%	0.759	S	S	*	*				158.7	144.8	111.1	-90.4	173.9	14.9	0	0	114.7
37	S	31.7	Very low	31.3	Very low	113 Å²	113	142.7 Å²	142.7	79%	0.79	77%	0.765	S	S	*	*			trans	74.8	136.6	156	80.2	0	0	0	0	115.7
38	N	30.1	Very low	31.2	Very low	141 Å²	141	141.1 Å²	141.1	75%	0.754	77%	0.765	S	S	*	*			cis	-171.8	145.2	17.4	-149.5	1.7	0	0	0	106.3
39	P	31.8	Very low	31	Very low	110 Å²	110	134.2 Å²	134.2	71%	0.714	76%	0.755	S	S	*	*			trans	-124.4	97	162.2	34.3	-19.3	0	0	0	111.1
40	Y	30	Very low	30.8	Very low	219 Å²	219	136.7 Å²	136.7	86%	0.859	76%	0.76	S	S	*	*			trans	-155.6	115.8	156.5	-88.1	-75.6	0	0	0	109.6
41	S	33.8	Very low	30.7	Very low	105 Å²	105	135 Å²	135	73%	0.734	76%	0.762	S	S	*	*			trans	-149.2	96.5	157.5	170.6	0	0	0	0	108.7
42	V	28.5	Very low	30.8	Very low	115 Å²	115	133.9 Å²	133.9	70%	0.697	77%	0.765	S	S	*	*			trans	-66.6	128.4	159.5	170.9	0	0	0	0	108.1
43	F	32.9	Very low	30.7	Very low	182 Å²	182	133.4 Å²	133.4	80%	0.798	77%	0.765	S	S	*	*			trans	-146.5	142.8	154.9	-92	-75.6	0	0	0	111.6
44	H	31.7	Very low	31	Very low	153 Å²	153	135.5 Å²	135.5	71%	0.708	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-67.2	157.4	-159.3	-67.8	-101.4	0	0	0	117.1
45	P	29.9	Very low	31	Very low	125 Å²	125	133.8 Å²	133.8	81%	0.812	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-88.7	124.1	153.4	33.4	-23.9	0	0	0	110
46	I	32.7	Very low	31.1	Very low	155 Å²	155	136.3 Å²	136.3	80%	0.795	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-84.1	119.1	169.1	-66.3	172.6	0	0	0	108.1
47	S	24.8	Very low	31.2	Very low	109 Å²	109	135 Å²	135	76%	0.762	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-81.8	131.1	167.6	-176.4	0	0	0	0	109.2
48	L	32.7	Very low	31.2	Very low	153 Å²	153	135.8 Å²	135.8	80%	0.801	76%	0.755	S	S	*	*			trans	-145.4	101.3	158.9	-100.5	156	0	0	0	107.2
49	G	24.6	Very low	31.2	Very low	57 Å²	57	133.9 Å²	133.9	59%	0.588	75%	0.753	S	S	*	*			trans	-80.4	152.1	169.3	0	0	0	0	0	111
50	F	31.3	Very low	31.3	Very low	204 Å²	204	136.2 Å²	136.2	90%	0.895	76%	0.755	S	S	*	*			trans	-140.3	139.6	149.3	-105.7	-82.8	0	0	0	109.7
51	T	29.3	Very low	31.3	Very low	133 Å²	133	134 Å²	134	82%	0.816	75%	0.749	S	S	*	*			trans	-99.1	158.8	-161.3	47.4	0	0	0	0	112.8
52	G	32.5	Very low	31.3	Very low	68 Å²	68	135.9 Å²	135.9	70%	0.701	76%	0.757	S	S	*	*			trans	105.4	138.4	152.8	0	0	0	0	0	113.8
53	C	31.9	Very low	31.4	Very low	110 Å²	110	136.3 Å²	136.3	74%	0.743	76%	0.76	S	S	*	*			cis	-163.3	146.4	8.3	-88.9	0	0	0	0	107.6
54	K	36.9	Very low	31.3	Very low	178 Å²	178	133.5 Å²	133.5	77%	0.774	76%	0.76	S	S	*	*				44.8	142.1	129	-58	-175.8	177.3	179.9	0	118.9
55	D	33.9	Very low	31.2	Very low	123 Å²	123	134.2 Å²	134.2	66%	0.658	77%	0.768	S	S	*	*			cis	178.4	153.3	0.5	-105.3	-27.7	0	0	0	106.3
56	I	33.4	Very low	31.1	Very low	138 Å²	138	138.1 Å²	138.1	71%	0.708	77%	0.768	S	S	*	*			trans	74.5	103.5	141.6	-61.9	164.5	0	0	0	119.8
57	L	29.9	Very low	31.1	Very low	144 Å²	144	137.7 Å²	137.7	75%	0.754	77%	0.766	S	S	*	*				42.5	117.9	115.8	-90.3	132	0	0	0	119.1
58	T	33	Very low	31.4	Very low	129 Å²	129	136.9 Å²	136.9	79%	0.791	76%	0.758	S	S	*	*				168.4	154	95.6	36.4	0	0	0	0	112.4
59	S	29.8	Very low	31.5	Very low	102 Å²	102	137 Å²	137	71%	0.713	76%	0.758	S	S	*	*			trans	-46.8	149.3	-179.2	54.4	0	0	0	0	119.7
60	E	33.3	Very low	31.9	Very low	158 Å²	158	139 Å²	139	74%	0.738	76%	0.763	S	S	*	*				135.6	114.9	126.7	-70.4	-146.3	123.7	0	0	115.5
61	K	29.8	Very low	31.9	Very low	173 Å²	173	136.2 Å²	136.2	75%	0.752	76%	0.758	S	S	*	*			trans	31.2	114.8	144.3	-66.4	168	-178.5	155.1	0	118.7
62	T	33.4	Very low	32.2	Very low	144 Å²	144	139.3 Å²	139.3	88%	0.883	76%	0.763	S	S	*	*				-170.3	155.1	121.3	11	0	0	0	0	112.4
63	T	31.8	Very low	32.2	Very low	125 Å²	125	139 Å²	139	77%	0.767	76%	0.761	S	S	*	*			trans	-52.3	163.9	-174.3	24.6	0	0	0	0	118.2
64	P	30.7	Very low	32.4	Very low	122 Å²	122	145 Å²	145	79%	0.792	77%	0.769	S	S	*	*			trans	-85.6	144.3	-165.4	35.2	-33.1	0	0	0	113.1
65	L	30.3	Very low	32.2	Very low	169 Å²	169	141.7 Å²	141.7	89%	0.885	77%	0.768	S	S	*	*			trans	-111	128.8	174.2	-85.5	169.4	0	0	0	111.9
66	Y	27.9	Very low	32.4	Very low	206 Å²	206	140.5 Å²	140.5	81%	0.808	77%	0.769	S	S	*	*			trans	-65.3	137.1	165.9	-168.3	-99.7	0	0	0	109.8	P68	Y66-P68 HydrophobicContact CD1-CG 4.03Å; Y66-P68 HydrophobicContact CE1-CB 4.22Å; Y66-P68 HydrophobicContact CE1-CG 4.06Å
67	I	32.8	Very low	32.5	Very low	147 Å²	147	140.4 Å²	140.4	75%	0.754	78%	0.775	S	S	*	*			trans	-112.9	120.2	171.4	-58.6	173.1	0	0	0	108.1
68	P	30.1	Very low	32.7	Very low	91 Å²	91	136.6 Å²	136.6	59%	0.591	77%	0.771	S	S	*	*			trans	-117.2	135.1	155.2	34.5	-20.9	0	0	0	110.8	Y66	Y66-P68 HydrophobicContact CD1-CG 4.03Å; Y66-P68 HydrophobicContact CE1-CB 4.22Å; Y66-P68 HydrophobicContact CE1-CG 4.06Å
69	L	35	Very low	32.8	Very low	156 Å²	156	136 Å²	136	82%	0.817	77%	0.772	S	S	*	*			trans	-143.8	107.7	164.6	-71.5	168	0	0	0	104.2
70	S	33.2	Very low	32.7	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	78%	0.776	S	S	*	*				43.1	135	71.6	-64.9	0	0	0	0	111.8
71	D	30.1	Very low	32.8	Very low	145 Å²	145	134.8 Å²	134.8	78%	0.775	78%	0.781	S	S	*	*			cis	-176.6	125.3	-8.8	-102.1	-42.3	0	0	0	100.8
72	E	36.8	Very low	32.9	Very low	198 Å²	198	133 Å²	133	93%	0.925	78%	0.784	S	S	*	*			trans	-154.2	114.9	154.4	-77.5	-150.8	170.1	0	0	108.9
73	G	31.7	Very low	32.9	Very low	63 Å²	63	131.6 Å²	131.6	65%	0.649	78%	0.778	S	S	*	*			trans	-97	162	177.2	0	0	0	0	0	112.4
74	Y	36.3	Very low	32.9	Very low	235 Å²	235	131.2 Å²	131.2	92%	0.922	78%	0.776	S	S	*	*			trans	-146.2	134.5	147.4	-91.1	-79	0	0	0	110.6
75	S	32.7	Very low	32.8	Very low	108 Å²	108	131.6 Å²	131.6	76%	0.755	77%	0.771	S	S	*	*			trans	-54.1	151.5	-179.3	-175.9	0	0	0	0	115.7
76	S	37.9	Very low	33	Very low	98 Å²	98	133.2 Å²	133.2	69%	0.685	77%	0.771	S	S	*	*				177.4	121	111.4	-151.7	0	0	0	0	113.3
77	V	36.9	Very low	33	Very low	137 Å²	137	127.9 Å²	127.9	83%	0.83	76%	0.764	S	S	*	*			trans	37.2	140.5	140.1	-50.9	0	0	0	0	121
78	G	32.7	Very low	33	Very low	64 Å²	64	127.6 Å²	127.6	66%	0.66	76%	0.764	S	S	*	*			cis	173.9	172	7.2	0	0	0	0	0	111.7
79	S	34.6	Very low	33.2	Very low	116 Å²	116	130.3 Å²	130.3	81%	0.811	77%	0.773	S	S	*	*			trans	63.6	103.1	163.9	40.9	0	0	0	0	118.3
80	S	28.8	Very low	32.9	Very low	114 Å²	114	129.9 Å²	129.9	80%	0.797	77%	0.771	S	S	*	*				77.9	107.9	60.1	78.4	0	0	0	0	115.2
81	S	35.3	Very low	32.6	Very low	121 Å²	121	130.6 Å²	130.6	85%	0.846	77%	0.774	S	S	*	*			trans	175.1	108	131.5	52.7	0	0	0	0	111.4
82	T	31.4	Very low	32.4	Very low	135 Å²	135	129.4 Å²	129.4	83%	0.828	77%	0.772	S	S	*	*			trans	-94.5	159.6	150.4	44.4	0	0	0	0	108.2
83	P	34.5	Very low	31.9	Very low	114 Å²	114	124.7 Å²	124.7	74%	0.74	76%	0.76	S	S	*	*				-150.7	141.9	98.2	27.4	-4.3	0	0	0	117.1
84	T	30.6	Very low	31.8	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.724	77%	0.77	S	S	*	*			trans	38.1	143.5	130.8	19.6	0	0	0	0	126.1
85	D	29.9	Very low	31.4	Very low	130 Å²	130	127 Å²	127	70%	0.695	77%	0.766	S	S	*	*			trans	84.4	111.8	143.8	-60.1	-25	0	0	0	120.6
86	F	33	Very low	31.1	Very low	203 Å²	203	128.5 Å²	128.5	89%	0.89	76%	0.764	S	S	*	*				-172.7	126.2	98.7	-104.1	-80.5	0	0	0	110.8
87	S	28.6	Very low	30.6	Very low	94 Å²	94	129.1 Å²	129.1	66%	0.657	76%	0.76	S	S	*	*			trans	-67.6	147.8	170.6	58.9	0	0	0	0	112
88	N	33.5	Very low	30.2	Very low	140 Å²	140	131.8 Å²	131.8	75%	0.749	76%	0.764	S	S	*	*			trans	-175.1	104	135.5	-86.8	-25.3	0	0	0	112.2
89	N	33.9	Very low	29.9	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	77%	0.772	S	S	*	*			trans	45.7	108.5	131.8	-57.2	-33.8	0	0	0	122
90	L	29	Very low	29.6	Very low	147 Å²	147	140.6 Å²	140.6	77%	0.77	77%	0.765	S	S	*	*			trans	-4.8	153.2	144.4	-122.7	66.2	0	0	0	119.6	T92	L90-T92 WeakPolarHBondContact CD2-OG1 3.32Å
91	P	27.1	Very low	29.5	Very low	115 Å²	115	143.2 Å²	143.2	75%	0.747	77%	0.77	S	S	*	*				-137.2	134.7	69	33.3	-15	0	0	0	116.5	S93	P91-S93 PolarHBondContact O-N 3.05Å
92	T	24.8	Very low	29.1	Very low	120 Å²	120	147.6 Å²	147.6	74%	0.736	77%	0.769	S	S	*	*			trans	-9.5	94.4	144.2	-40.1	0	0	0	0	116.3	L90	L90-T92 WeakPolarHBondContact CD2-OG1 3.32Å
93	S	26.8	Very low	28.9	Very low	98 Å²	98	152 Å²	152	69%	0.685	77%	0.771	S	S	*	*			trans	-158.7	-7	158.3	57.3	0	0	0	0	116.7	P91	P91-S93 PolarHBondContact O-N 3.05Å
94	E	29.4	Very low	28.5	Very low	181 Å²	181	150.7 Å²	150.7	85%	0.846	76%	0.763	S	S	*	*	S	Bend	trans	-111.9	7.4	-169	-73	-174.4	153.4	0	0	117.3
95	I	28.4	Very low	28.5	Very low	166 Å²	166	152.5 Å²	152.5	85%	0.851	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	5.5	-178.8	-61.9	178	0	0	0	113.6
96	I	26.6	Very low	28.4	Very low	139 Å²	139	153.4 Å²	153.4	71%	0.713	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	4	-173.9	-65.9	177.9	0	0	0	115.1
97	N	27.6	Very low	28.1	Very low	112 Å²	112	148.5 Å²	148.5	60%	0.599	76%	0.756	S	S	*	*	S	Bend	trans	-121.2	12	-174.2	-74.9	-33.7	0	0	0	117.6
98	Q	27.8	Very low	28.3	Very low	193 Å²	193	150.4 Å²	150.4	90%	0.902	76%	0.757	S	S	*	*	S	Bend	trans	-97.8	9	170.5	-85.3	-178.2	-7.4	0	0	115.1
99	Y	26.7	Very low	28.4	Very low	210 Å²	210	149.5 Å²	149.5	82%	0.824	75%	0.748	S	S	*	*	S	Bend	trans	-116.8	32.5	174	-80.8	-80.7	0	0	0	113.4
100	K	27.5	Very low	28.6	Very low	155 Å²	155	147.1 Å²	147.1	67%	0.674	74%	0.736	S	S	*	*			trans	-115.7	13.3	-179.2	-81.4	-175.4	178.5	171.7	0	116.3
101	D	26.8	Very low	29	Very low	169 Å²	169	142.3 Å²	142.3	90%	0.904	71%	0.714	S	S	*	*			trans	-104.7	17.3	176.2	-82.5	-15.4	0	0	0	114.8	R103	D101-R103 PolarHBondContact O-N 2.94Å
102	Y	26.8	Very low	29.9	Very low	212 Å²	212	141 Å²	141	83%	0.831	70%	0.7	S	S	*	*			trans	-86.9	81.6	161.2	-84.1	-85.2	0	0	0	109.1
103	R	27.9	Very low	31.3	Very low	228 Å²	228	137.3 Å²	137.3	86%	0.86	68%	0.676	S	S	*	*			trans	-62.1	129.8	155	-93.4	-167	-173.4	-140.6	1.8	107.4	D101 I105	D101-R103 PolarHBondContact O-N 2.94Å; R103-I105 PolarHBondContact O-N 3.13Å
104	P	26.1	Very low	32.5	Very low	87 Å²	87	136 Å²	136	57%	0.565	66%	0.659	S	S	*	*			trans	-65.5	122.9	174.2	26.6	-29.7	0	0	0	108.2	E106	P104-E106 HydrophobicContact CB-CB 3.96Å; P104-E106 HydrophobicContact CB-CG 3.76Å; P104-E106 PolarHBondContact O-N 3.09Å
105	I	29.5	Very low	33.7	Very low	155 Å²	155	134.2 Å²	134.2	80%	0.795	65%	0.645	S	S	*	*			trans	-74.2	64.2	161.4	-55.1	172.8	0	0	0	106.1	R103	R103-I105 PolarHBondContact O-N 3.13Å
106	E	27.8	Very low	35.2	Very low	149 Å²	149	129.4 Å²	129.4	70%	0.696	62%	0.618	S	S	*	*			trans	-128.9	96.3	177.2	-63.4	174.8	170.1	0	0	101.9	P104	P104-E106 HydrophobicContact CB-CB 3.96Å; P104-E106 HydrophobicContact CB-CG 3.76Å; P104-E106 PolarHBondContact O-N 3.09Å
107	C	28.4	Very low	36.9	Very low	100 Å²	100	128.2 Å²	128.2	68%	0.676	61%	0.608	S	S	*	*	S	Bend		-159.6	-4.5	91.7	-70.4	0	0	0	0	112.7
108	I	31.5	Very low	38.5	Very low	135 Å²	135	125.5 Å²	125.5	69%	0.692	59%	0.593	S	S	*	*	H	α-helix	trans	-84.7	-32.2	-172.2	-55.5	171.7	0	0	0	111.7	N110 S111 I112	I108-N110 VanDerWaalsContact C-N 3.28Å; I108-N110 PolarHBondContact O-N 2.91Å; I108-S111 PolarHBondContact O-OG 3.32Å; I108-I112 HydrophobicContact CG2-CD1 4.49Å
109	H	35.2	Very low	40.3	Very low	121 Å²	121	121 Å²	121	56%	0.56	57%	0.572	S	S	*	*	H	α-helix	trans	-76.8	-17.8	177.4	-129.4	-68.5	0	0	0	112.7	N113	H109-N113 VanDerWaalsContact O-CB 3.24Å; H109-N113 WeakPolarHBondContact O-CB 3.38Å; H109-N113 VanDerWaalsContact O-CG 3.32Å; H109-N113 PolarHBondContact O-N 3.12Å; H109-N113 PolarHBondContact O-ND2 3.49Å
110	N	38	Very low	42.2	Very low	98 Å²	98	113.4 Å²	113.4	52%	0.524	55%	0.545	S	S	.	.	H	α-helix	trans	-81.2	-37.1	-176.9	-131.2	6.4	0	0	0	111.5	I108 Q114	I108-N110 VanDerWaalsContact C-N 3.28Å; I108-N110 PolarHBondContact O-N 2.91Å; N110-Q114 WeakPolarHBondContact O-CB 3.41Å; N110-Q114 VanDerWaalsContact O-CG 3.24Å; N110-Q114 WeakPolarHBondContact O-CG 3.43Å; N110-Q114 PolarHBondContact O-N 2.84Å
111	S	39.2	Very low	44.1	Very low	46 Å²	46	109.6 Å²	109.6	32%	0.322	54%	0.535	S	S	.	.	H	α-helix	trans	-71.8	-40.6	176.4	57.7	0	0	0	0	112.5	I108 Q114 R115	I108-S111 PolarHBondContact O-OG 3.32Å; S111-Q114 PolarHBondContact O-N 3.43Å; S111-Q114 VanDerWaalsContact O-N 3.17Å; S111-R115 PolarHBondContact O-N 2.86Å
112	I	46.1	Very low	45.8	Very low	86 Å²	86	102.9 Å²	102.9	44%	0.441	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-45.3	172.8	-64.3	168.4	0	0	0	110.2	I108 Q114 R115 E116	I108-I112 HydrophobicContact CG2-CD1 4.49Å; I112-Q114 VanDerWaalsContact C-N 3.31Å; I112-Q114 PolarHBondContact O-N 3.45Å; I112-R115 PolarHBondContact O-N 3.4Å; I112-E116 WeakPolarHBondContact O-CG 3.17Å; I112-E116 PolarHBondContact O-N 3.23Å
113	N	54	Low	47.7	Very low	44 Å²	44	97.8 Å²	97.8	24%	0.235	49%	0.489	C	S	.	.	H	α-helix	trans	-62.9	-34.1	173.9	-89.3	-52.3	0	0	0	112.8	H109 K117	H109-N113 VanDerWaalsContact O-CB 3.24Å; H109-N113 WeakPolarHBondContact O-CB 3.38Å; H109-N113 VanDerWaalsContact O-CG 3.32Å; H109-N113 PolarHBondContact O-N 3.12Å; H109-N113 PolarHBondContact O-ND2 3.49Å; N113-K117 VanDerWaalsContact O-CB 3.28Å; N113-K117 WeakPolarHBondContact O-CB 3.44Å; N113-K117 VanDerWaalsContact O-CD 3.32Å; N113-K117 WeakPolarHBondContact O-CD 3.3Å; N113-K117 WeakPolarHBondContact O-CG 3.27Å; N113-K117 PolarHBondContact O-N 3.35Å
114	Q	51	Low	49.6	Very low	71 Å²	71	91.4 Å²	91.4	33%	0.332	47%	0.469	S	S	.	.	H	α-helix	trans	-71.5	-42.6	177.3	-79.9	-179.6	3.8	0	0	111.9	N110 S111 I112 K117 L118	N110-Q114 WeakPolarHBondContact O-CB 3.41Å; N110-Q114 VanDerWaalsContact O-CG 3.24Å; N110-Q114 WeakPolarHBondContact O-CG 3.43Å; N110-Q114 PolarHBondContact O-N 2.84Å; S111-Q114 PolarHBondContact O-N 3.43Å; S111-Q114 VanDerWaalsContact O-N 3.17Å; I112-Q114 VanDerWaalsContact C-N 3.31Å; I112-Q114 PolarHBondContact O-N 3.45Å; Q114-K117 PolarHBondContact O-N 2.78Å; Q114-L118 WeakPolarHBondContact O-CB 3.39Å; Q114-L118 VanDerWaalsContact O-CG 3.3Å; Q114-L118 WeakPolarHBondContact O-CG 3.46Å; Q114-L118 PolarHBondContact O-N 3.05Å
115	R	54.7	Low	51.5	Low	143 Å²	143	89.4 Å²	89.4	54%	0.54	45%	0.454	S	S	.	.	H	α-helix	trans	-59.1	-49.3	174.4	-175.6	-179.1	-178.7	-76.3	-1.9	111.1	S111 I112 K117 L118 E119	S111-R115 PolarHBondContact O-N 2.86Å; I112-R115 PolarHBondContact O-N 3.4Å; R115-K117 PolarHBondContact O-N 3.27Å; R115-L118 PolarHBondContact O-N 2.69Å; R115-E119 IonicContact NH1-OE2 3.9Å; R115-E119 PolarHBondContact NH1-OE2 3.38Å; R115-E119 VanDerWaalsContact NH1-OE2 3.17Å; R115-E119 WeakPolarHBondContact O-CB 3.29Å; R115-E119 PolarHBondContact O-N 3.44Å
116	E	60	Low	53.3	Low	65 Å²	65	85.4 Å²	85.4	30%	0.304	43%	0.434	S	S	.	.	H	α-helix	trans	-63.4	-39.8	177.7	-70.8	-178.2	178.5	0	0	112.4	I112 L118 E119 I120 Y488	I112-E116 WeakPolarHBondContact O-CG 3.17Å; I112-E116 PolarHBondContact O-N 3.23Å; E116-L118 VanDerWaalsContact C-N 3.34Å; E116-L118 PolarHBondContact O-N 2.89Å; E116-E119 PolarHBondContact O-N 2.85Å; E116-I120 VanDerWaalsContact O-CG1 3.31Å; E116-I120 WeakPolarHBondContact O-CG1 3.49Å; E116-I120 PolarHBondContact O-N 3.49Å; E116-Y488 HydrophobicContact CB-CE1 3.93Å; E116-Y488 VanDerWaalsContact CB-OH 3.25Å; E116-Y488 WeakPolarHBondContact CB-OH 3.48Å; E116-Y488 PolarHBondContact OE2-OH 3.17Å
117	K	62.4	Low	55.2	Low	114 Å²	114	81.9 Å²	81.9	50%	0.496	42%	0.42	S	S	.	.	H	α-helix	trans	-61	-42	174	-78.8	168.6	-173.9	178.9	0	112	N113 Q114 R115 I120 V121	N113-K117 VanDerWaalsContact O-CB 3.28Å; N113-K117 WeakPolarHBondContact O-CB 3.44Å; N113-K117 VanDerWaalsContact O-CD 3.32Å; N113-K117 WeakPolarHBondContact O-CD 3.3Å; N113-K117 WeakPolarHBondContact O-CG 3.27Å; N113-K117 PolarHBondContact O-N 3.35Å; Q114-K117 PolarHBondContact O-N 2.78Å; R115-K117 PolarHBondContact O-N 3.27Å; K117-I120 PolarHBondContact O-N 3.21Å; K117-V121 VanDerWaalsContact O-CG2 3.31Å; K117-V121 WeakPolarHBondContact O-CG2 3.36Å; K117-V121 PolarHBondContact O-N 3.39Å
118	L	61.1	Low	57	Low	55 Å²	55	81.2 Å²	81.2	29%	0.288	41%	0.406	S	S	.	.	H	α-helix	trans	-69.7	-37.3	178.9	-72.7	164.6	0	0	0	111.5	Q114 R115 E116 V121 A122 L267	Q114-L118 WeakPolarHBondContact O-CB 3.39Å; Q114-L118 VanDerWaalsContact O-CG 3.3Å; Q114-L118 WeakPolarHBondContact O-CG 3.46Å; Q114-L118 PolarHBondContact O-N 3.05Å; R115-L118 PolarHBondContact O-N 2.69Å; E116-L118 VanDerWaalsContact C-N 3.34Å; E116-L118 PolarHBondContact O-N 2.89Å; L118-V121 PolarHBondContact O-N 3.43Å; L118-A122 WeakPolarHBondContact O-CB 3.3Å; L118-A122 PolarHBondContact O-N 2.85Å; L118-L267 HydrophobicContact CB-CD1 4.14Å; L118-L267 HydrophobicContact CB-CD2 4.21Å; L118-L267 HydrophobicContact CD1-CD1 4.33Å; L118-L267 HydrophobicContact CD1-CD2 3.44Å; L118-L267 VanDerWaalsContact CD1-CD2 3.44Å; L118-L267 HydrophobicContact CD1-CG 3.87Å; L118-L267 HydrophobicContact CG-CD2 4.41Å
119	E	65.5	Low	58	Low	97 Å²	97	76.4 Å²	76.4	45%	0.453	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-40.8	174.5	-164.4	167.5	178.6	0	0	111.7	R115 E116 A122 L123	R115-E119 IonicContact NH1-OE2 3.9Å; R115-E119 PolarHBondContact NH1-OE2 3.38Å; R115-E119 VanDerWaalsContact NH1-OE2 3.17Å; R115-E119 WeakPolarHBondContact O-CB 3.29Å; R115-E119 PolarHBondContact O-N 3.44Å; E116-E119 PolarHBondContact O-N 2.85Å; E119-A122 PolarHBondContact O-N 3.17Å; E119-L123 HydrophobicContact CG-CD1 4.48Å; E119-L123 WeakPolarHBondContact O-CB 3.21Å; E119-L123 VanDerWaalsContact O-CG 3.31Å; E119-L123 WeakPolarHBondContact O-CG 3.32Å; E119-L123 PolarHBondContact O-N 3.42Å
120	I	66	Low	59.2	Low	51 Å²	51	78.8 Å²	78.8	26%	0.262	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-47.5	171.7	-67.3	161.3	0	0	0	111.2	E116 K117 A122 L123 E124 Y488	E116-I120 VanDerWaalsContact O-CG1 3.31Å; E116-I120 WeakPolarHBondContact O-CG1 3.49Å; E116-I120 PolarHBondContact O-N 3.49Å; K117-I120 PolarHBondContact O-N 3.21Å; I120-A122 VanDerWaalsContact C-N 3.32Å; I120-A122 PolarHBondContact O-N 3.23Å; I120-L123 PolarHBondContact O-N 3.31Å; I120-E124 WeakPolarHBondContact O-CB 3.3Å; I120-E124 PolarHBondContact O-N 3.48Å; I120-Y488 HydrophobicContact CD1-CD1 3.6Å; I120-Y488 HydrophobicContact CD1-CE1 3.03Å; I120-Y488 HydrophobicContact CD1-CE2 4.26Å; I120-Y488 HydrophobicContact CD1-CG 4.42Å; I120-Y488 VanDerWaalsContact CD1-CZ 3.41Å; I120-Y488 HydrophobicContact CG1-CD1 3.54Å; I120-Y488 HydrophobicContact CG1-CE1 3.32Å
121	V	69.1	Low	60	Low	76 Å²	76	79.8 Å²	79.8	46%	0.461	40%	0.396	S	S	.	.	H	α-helix	trans	-62.6	-41.5	-179.3	171.3	0	0	0	0	110.7	K117 L118 E124 L125	K117-V121 VanDerWaalsContact O-CG2 3.31Å; K117-V121 WeakPolarHBondContact O-CG2 3.36Å; K117-V121 PolarHBondContact O-N 3.39Å; L118-V121 PolarHBondContact O-N 3.43Å; V121-E124 PolarHBondContact O-N 2.88Å; V121-L125 HydrophobicContact CG1-CD1 4.06Å; V121-L125 WeakPolarHBondContact O-CB 3.45Å; V121-L125 VanDerWaalsContact O-CG 3.31Å; V121-L125 WeakPolarHBondContact O-CG 3.31Å; V121-L125 PolarHBondContact O-N 2.86Å
122	A	61.4	Low	60.6	Low	27 Å²	27	80.5 Å²	80.5	22%	0.223	40%	0.395	C	S	.	.	H	α-helix	trans	-63.5	-44.2	176.1	0	0	0	0	0	112	L118 E119 I120 L125 L126	L118-A122 WeakPolarHBondContact O-CB 3.3Å; L118-A122 PolarHBondContact O-N 2.85Å; E119-A122 PolarHBondContact O-N 3.17Å; I120-A122 VanDerWaalsContact C-N 3.32Å; I120-A122 PolarHBondContact O-N 3.23Å; A122-L125 PolarHBondContact O-N 3.29Å; A122-L126 WeakPolarHBondContact O-CB 3.49Å; A122-L126 PolarHBondContact O-N 3.35Å
123	L	66.6	Low	60.4	Low	106 Å²	106	80 Å²	80	56%	0.555	40%	0.396	S	S	*	.	H	α-helix	trans	-65.8	-39.2	176.9	-74.3	170.9	0	0	0	112.5	E119 I120 L126 N127	E119-L123 HydrophobicContact CG-CD1 4.48Å; E119-L123 WeakPolarHBondContact O-CB 3.21Å; E119-L123 VanDerWaalsContact O-CG 3.31Å; E119-L123 WeakPolarHBondContact O-CG 3.32Å; E119-L123 PolarHBondContact O-N 3.42Å; I120-L123 PolarHBondContact O-N 3.31Å; L123-L126 PolarHBondContact O-N 3.32Å; L123-N127 VanDerWaalsContact O-CB 3.28Å; L123-N127 WeakPolarHBondContact O-CB 3.49Å; L123-N127 PolarHBondContact O-N 3.28Å
124	E	68.7	Low	59.7	Low	94 Å²	94	85.4 Å²	85.4	44%	0.439	43%	0.425	S	S	.	.	H	α-helix	trans	-65.9	-43.6	176.2	-178.8	57.5	-152.3	0	0	111.1	I120 V121 N127 Q128	I120-E124 WeakPolarHBondContact O-CB 3.3Å; I120-E124 PolarHBondContact O-N 3.48Å; V121-E124 PolarHBondContact O-N 2.88Å; E124-N127 PolarHBondContact O-N 3.35Å; E124-Q128 WeakPolarHBondContact O-CB 3.49Å; E124-Q128 VanDerWaalsContact O-CG 3.3Å; E124-Q128 WeakPolarHBondContact O-CG 3.33Å; E124-Q128 PolarHBondContact O-N 3.04Å; E124-Q128 PolarHBondContact OE1-NE2 2.99Å
125	L	65.5	Low	59	Low	45 Å²	45	91.7 Å²	91.7	24%	0.236	45%	0.447	C	S	.	.	H	α-helix	trans	-62.6	-42.2	173.1	-74.2	171.9	0	0	0	111.8	V121 A122 N127 Q128 A129	V121-L125 HydrophobicContact CG1-CD1 4.06Å; V121-L125 WeakPolarHBondContact O-CB 3.45Å; V121-L125 VanDerWaalsContact O-CG 3.31Å; V121-L125 WeakPolarHBondContact O-CG 3.31Å; V121-L125 PolarHBondContact O-N 2.86Å; A122-L125 PolarHBondContact O-N 3.29Å; L125-N127 VanDerWaalsContact C-N 3.29Å; L125-N127 PolarHBondContact O-N 3.35Å; L125-Q128 PolarHBondContact O-N 3.44Å; L125-A129 WeakPolarHBondContact O-CB 3.35Å; L125-A129 PolarHBondContact O-N 3.44Å
126	L	67.5	Low	58	Low	71 Å²	71	89.6 Å²	89.6	37%	0.372	46%	0.455	S	S	.	.	H	α-helix	trans	-63.8	-36	175.8	-159.3	91.1	0	0	0	111.6	A122 L123 A129 R130	A122-L126 WeakPolarHBondContact O-CB 3.49Å; A122-L126 PolarHBondContact O-N 3.35Å; L123-L126 PolarHBondContact O-N 3.32Å; L126-A129 WeakPolarHBondContact O-CB 3.33Å; L126-A129 PolarHBondContact O-N 3.49Å; L126-R130 WeakPolarHBondContact O-CG 3.39Å; L126-R130 PolarHBondContact O-N 2.83Å
127	N	67	Low	56.7	Low	75 Å²	75	89.6 Å²	89.6	40%	0.401	46%	0.461	S	S	.	.	H	α-helix	trans	-71.3	-40.1	176.5	-166	31.5	0	0	0	111.5	L123 E124 L125 A129 R130 L131	L123-N127 VanDerWaalsContact O-CB 3.28Å; L123-N127 WeakPolarHBondContact O-CB 3.49Å; L123-N127 PolarHBondContact O-N 3.28Å; E124-N127 PolarHBondContact O-N 3.35Å; L125-N127 VanDerWaalsContact C-N 3.29Å; L125-N127 PolarHBondContact O-N 3.35Å; N127-A129 VanDerWaalsContact C-N 3.35Å; N127-R130 WeakPolarHBondContact O-CA 3.25Å; N127-R130 PolarHBondContact O-N 3.17Å; N127-R130 VanDerWaalsContact O-N 3.13Å; N127-L131 WeakPolarHBondContact O-CG 3.3Å; N127-L131 PolarHBondContact O-N 3.36Å
128	Q	67.4	Low	55.3	Low	86 Å²	86	91.4 Å²	91.4	40%	0.402	48%	0.476	S	S	.	.	H	α-helix	trans	-63.1	-40.1	171.3	-70.6	174.8	20.8	0	0	111.4	E124 L125 R130 L131 I132	E124-Q128 WeakPolarHBondContact O-CB 3.49Å; E124-Q128 VanDerWaalsContact O-CG 3.3Å; E124-Q128 WeakPolarHBondContact O-CG 3.33Å; E124-Q128 PolarHBondContact O-N 3.04Å; E124-Q128 PolarHBondContact OE1-NE2 2.99Å; L125-Q128 PolarHBondContact O-N 3.44Å; Q128-R130 VanDerWaalsContact C-N 3.3Å; Q128-R130 PolarHBondContact O-N 3.22Å; Q128-L131 PolarHBondContact O-N 3.37Å; Q128-I132 WeakPolarHBondContact O-CG1 3.43Å; Q128-I132 PolarHBondContact O-N 2.92Å
129	A	52.2	Low	53.9	Low	34 Å²	34	91.9 Å²	91.9	28%	0.281	49%	0.494	S	S	.	.	H	α-helix	trans	-59.1	-42.8	170	0	0	0	0	0	111.7	L125 L126 N127 L131 I132 M256	L125-A129 WeakPolarHBondContact O-CB 3.35Å; L125-A129 PolarHBondContact O-N 3.44Å; L126-A129 WeakPolarHBondContact O-CB 3.33Å; L126-A129 PolarHBondContact O-N 3.49Å; N127-A129 VanDerWaalsContact C-N 3.35Å; A129-L131 VanDerWaalsContact C-N 3.32Å; A129-L131 PolarHBondContact O-N 3.36Å; A129-I132 PolarHBondContact O-N 3.27Å; A129-M256 HydrophobicContact CB-SD 3.32Å; A129-M256 WeakPolarHBondContact CB-SD 3.5Å
130	R	59.2	Low	52.3	Low	171 Å²	171	95.7 Å²	95.7	65%	0.645	51%	0.512	S	S	*	.	H	α-helix	trans	-39.7	-55.3	167.4	54.1	82	160.2	-172.1	-4.9	112.9	L126 N127 Q128 I132 T133	L126-R130 WeakPolarHBondContact O-CG 3.39Å; L126-R130 PolarHBondContact O-N 2.83Å; N127-R130 WeakPolarHBondContact O-CA 3.25Å; N127-R130 PolarHBondContact O-N 3.17Å; N127-R130 VanDerWaalsContact O-N 3.13Å; Q128-R130 VanDerWaalsContact C-N 3.3Å; Q128-R130 PolarHBondContact O-N 3.22Å; R130-I132 VanDerWaalsContact C-N 3.28Å; R130-I132 PolarHBondContact O-N 2.91Å; R130-T133 PolarHBondContact O-OG1 2.99Å
131	L	56.3	Low	50.7	Low	119 Å²	119	101.2 Å²	101.2	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-78.6	-11.1	-171.1	-67	167.4	0	0	0	113.6	N127 Q128 A129 T133	N127-L131 WeakPolarHBondContact O-CG 3.3Å; N127-L131 PolarHBondContact O-N 3.36Å; Q128-L131 PolarHBondContact O-N 3.37Å; A129-L131 VanDerWaalsContact C-N 3.32Å; A129-L131 PolarHBondContact O-N 3.36Å; L131-T133 VanDerWaalsContact C-N 3.27Å; L131-T133 PolarHBondContact O-N 3.48Å
132	I	51.1	Low	48.9	Very low	60 Å²	60	104.7 Å²	104.7	31%	0.308	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.3	-7.6	179.9	-68.6	168.4	0	0	0	111.8	Q128 A129 R130 L249 V252 M256	Q128-I132 WeakPolarHBondContact O-CG1 3.43Å; Q128-I132 PolarHBondContact O-N 2.92Å; A129-I132 PolarHBondContact O-N 3.27Å; R130-I132 VanDerWaalsContact C-N 3.28Å; R130-I132 PolarHBondContact O-N 2.91Å; I132-L249 HydrophobicContact CG2-CD2 3.32Å; I132-V252 HydrophobicContact CD1-CG1 4.37Å; I132-M256 HydrophobicContact CD1-CE 3.76Å
133	T	42.6	Very low	47.4	Very low	77 Å²	77	110.8 Å²	110.8	47%	0.472	58%	0.58	S	S	.	*	S	Bend	trans	-98	122	174.7	52.8	0	0	0	0	112	R130 L131	R130-T133 PolarHBondContact O-OG1 2.99Å; L131-T133 VanDerWaalsContact C-N 3.27Å; L131-T133 PolarHBondContact O-N 3.48Å
134	N	39.3	Very low	45.5	Very low	156 Å²	156	116.3 Å²	116.3	83%	0.834	59%	0.594	S	S	*	*			trans	102.5	32.6	171.4	-52.7	-28	0	0	0	118.7	S136	N134-S136 PolarHBondContact O-N 3.01Å
135	Y	35.9	Very low	43.7	Very low	204 Å²	204	118.6 Å²	118.6	80%	0.8	61%	0.609	S	S	*	*			trans	-79.8	100.9	152.1	-73.3	-78.3	0	0	0	108.8	C137	Y135-C137 PolarHBondContact O-N 3.11Å
136	S	34.1	Very low	42.1	Very low	99 Å²	99	124.3 Å²	124.3	69%	0.692	64%	0.638	S	S	*	*			trans	-64.2	116.9	163.7	-169.8	0	0	0	0	107.5	N134 N138	N134-S136 PolarHBondContact O-N 3.01Å; S136-N138 PolarHBondContact O-N 3.34Å
137	C	32.7	Very low	40.4	Very low	65 Å²	65	128.2 Å²	128.2	44%	0.439	66%	0.659	S	S	.	*	S	Bend	trans	-68.4	61.5	174.5	-65.8	0	0	0	0	110.9	Y135 D242	Y135-C137 PolarHBondContact O-N 3.11Å; C137-D242 WeakPolarHBondContact CB-OD1 3.5Å; C137-D242 PolarHBondContact SG-OD1 2.96Å
138	N	31.8	Very low	38.5	Very low	151 Å²	151	136.3 Å²	136.3	81%	0.807	68%	0.684	S	S	*	*			trans	-136.8	69.7	173.1	-87	-20.8	0	0	0	108.5	S136	S136-N138 PolarHBondContact O-N 3.34Å
139	G	32.4	Very low	36.9	Very low	65 Å²	65	139.8 Å²	139.8	67%	0.67	70%	0.702	S	S	*	*			trans	-136.8	93.1	175.5	0	0	0	0	0	109.7	L141	G139-L141 PolarHBondContact O-N 3.3Å
140	H	30.8	Very low	35.9	Very low	177 Å²	177	145.8 Å²	145.8	82%	0.819	73%	0.729	S	S	*	*			trans	-62.2	93.2	177	-147	-25.8	0	0	0	109.4	H142	H140-H142 PolarHBondContact O-N 3.39Å; H140-H142 VanDerWaalsContact O-N 3.09Å
141	L	32.6	Very low	34.7	Very low	168 Å²	168	147.1 Å²	147.1	88%	0.88	74%	0.743	S	S	*	*			trans	-74.3	96.7	168.2	-87.3	162.3	0	0	0	107.9	G139 N143	G139-L141 PolarHBondContact O-N 3.3Å; L141-N143 PolarHBondContact O-N 3.34Å; L141-N143 VanDerWaalsContact O-N 3.13Å
142	H	31.7	Very low	33.9	Very low	149 Å²	149	149.8 Å²	149.8	69%	0.69	75%	0.752	S	S	*	*			trans	-59.2	112.4	162.3	-110.5	65.6	0	0	0	108.3	H140 R144	H140-H142 PolarHBondContact O-N 3.39Å; H140-H142 VanDerWaalsContact O-N 3.09Å; H142-R144 PolarHBondContact O-N 3.38Å
143	N	29.3	Very low	33.3	Very low	154 Å²	154	153.2 Å²	153.2	82%	0.824	77%	0.771	S	S	*	*			trans	-57.6	98.3	166.8	-117.8	-23.1	0	0	0	108.6	L141	L141-N143 PolarHBondContact O-N 3.34Å; L141-N143 VanDerWaalsContact O-N 3.13Å
144	R	28.5	Very low	33.2	Very low	223 Å²	223	156.7 Å²	156.7	84%	0.842	79%	0.787	S	S	*	*			trans	-112.8	79.7	162.3	-87.6	-171.4	175.5	167.9	-0.4	107.5	H142	H142-R144 PolarHBondContact O-N 3.38Å
145	N	29.9	Very low	33.1	Very low	142 Å²	142	159 Å²	159	76%	0.759	79%	0.789	S	S	*	*	S	Bend	trans	-171.1	140.4	149.8	-82.7	-33.7	0	0	0	105.4
146	I	31.9	Very low	33.2	Very low	164 Å²	164	154.6 Å²	154.6	84%	0.841	79%	0.786	S	S	*	*			trans	92.9	75.8	-170.6	-46.2	160.7	0	0	0	113.2
147	L	31	Very low	33.5	Very low	154 Å²	154	155 Å²	155	81%	0.806	79%	0.786	S	S	*	*				-176.1	89.8	128.1	-100.6	153.9	0	0	0	108	M149	L147-M149 HydrophobicContact CD2-CB 4.41Å; L147-M149 HydrophobicContact CD2-CG 4.25Å
148	R	27	Very low	33.5	Very low	244 Å²	244	158 Å²	158	92%	0.921	80%	0.803	S	S	*	*			trans	-90.4	88.6	160.9	-171.3	-171.5	-162.4	-159.3	5.2	105.3
149	M	34.1	Very low	33.6	Very low	160 Å²	160	156 Å²	156	79%	0.788	80%	0.8	S	S	*	*			trans	-140.5	133.7	163.6	-74.3	-58.5	-109.7	0	0	108.7	L147	L147-M149 HydrophobicContact CD2-CB 4.41Å; L147-M149 HydrophobicContact CD2-CG 4.25Å
150	N	32.9	Very low	33.6	Very low	159 Å²	159	158 Å²	158	85%	0.85	80%	0.804	S	S	*	*			trans	-61.1	133.5	-179.3	-57.7	-37.4	0	0	0	110.7
151	E	33.8	Very low	33.7	Very low	200 Å²	200	155 Å²	155	94%	0.935	80%	0.803	S	S	*	*			trans	-134.6	107.5	154.1	-89.9	-175.3	158.8	0	0	108.3
152	E	38.4	Very low	33.6	Very low	174 Å²	174	152.2 Å²	152.2	81%	0.813	80%	0.798	S	S	*	*			trans	-111.3	133.2	163.4	-116.8	-178.6	-175	0	0	107.2
153	N	39.8	Very low	33.6	Very low	132 Å²	132	151 Å²	151	71%	0.706	81%	0.806	S	S	*	*			trans	100	117	155.9	-55.4	-41.8	0	0	0	119.8
154	N	40.1	Very low	33.4	Very low	150 Å²	150	149.5 Å²	149.5	80%	0.802	81%	0.807	S	S	*	*			trans	102.8	80	142	-58.6	-30.1	0	0	0	119.8
155	K	36.4	Very low	33.6	Very low	204 Å²	204	144.9 Å²	144.9	89%	0.887	81%	0.809	S	S	*	*				49.7	133.2	121.2	-125.9	173.3	-176.7	-178.2	0	121.3
156	P	37.8	Very low	33.4	Very low	112 Å²	112	142.7 Å²	142.7	73%	0.727	81%	0.805	S	S	*	*			trans	-101.6	-174.6	-173.9	45.1	-37.7	0	0	0	112.8
157	P	40.3	Very low	33.4	Very low	109 Å²	109	144 Å²	144	71%	0.708	81%	0.805	S	S	*	*				-156.8	153.8	85.7	40.9	-19.8	0	0	0	118.9
158	T	32.6	Very low	33.5	Very low	128 Å²	128	144.2 Å²	144.2	79%	0.785	80%	0.8	S	S	*	*			trans	33.8	127.4	140	62.1	0	0	0	0	123.6
159	S	34.4	Very low	33.5	Very low	107 Å²	107	139.5 Å²	139.5	75%	0.748	79%	0.788	S	S	*	*				-178.1	132	120.2	55.1	0	0	0	0	113.2
160	S	32.6	Very low	33.5	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	79%	0.791	S	S	*	*			trans	18.6	140.4	143.8	58.2	0	0	0	0	119.8
161	S	33.4	Very low	33.2	Very low	113 Å²	113	141.6 Å²	141.6	79%	0.79	79%	0.787	S	S	*	*				-176	153.3	52.9	43.2	0	0	0	0	112
162	S	29.3	Very low	33.3	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	78%	0.781	S	S	*	*			trans	-54.4	148.7	169.1	46.4	0	0	0	0	117.5
163	S	32.2	Very low	32.8	Very low	123 Å²	123	137.5 Å²	137.5	86%	0.86	78%	0.778	S	S	*	*			trans	-171.8	122.1	133.4	47.4	0	0	0	0	112.4
164	S	25.9	Very low	32.3	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	79%	0.788	S	S	*	*			trans	-77.1	146.2	170.2	47.8	0	0	0	0	112.7
165	S	31.8	Very low	31.7	Very low	126 Å²	126	143.2 Å²	143.2	88%	0.881	79%	0.787	S	S	*	*			trans	-145.5	124.9	156	61.1	0	0	0	0	112
166	S	25.7	Very low	31.3	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	78%	0.775	S	S	*	*			trans	-75.9	149.3	-178.2	170.7	0	0	0	0	113.8
167	F	31.2	Very low	30.7	Very low	193 Å²	193	137 Å²	137	85%	0.846	77%	0.769	S	S	*	*			trans	-162.6	112.8	144.1	-93.7	-80.4	0	0	0	106.5
168	K	33.2	Very low	30.2	Very low	158 Å²	158	137.7 Å²	137.7	69%	0.687	78%	0.777	S	S	*	*				52.6	136.5	85.9	-76.4	-177.1	168.2	-159.5	0	111.6
169	E	28.4	Very low	29.9	Very low	145 Å²	145	139.9 Å²	139.9	68%	0.678	78%	0.778	S	S	*	*			cis	-174.2	176.7	12.9	-122.9	163.3	152.6	0	0	105.3
170	Y	33.5	Very low	29.7	Very low	216 Å²	216	139.9 Å²	139.9	85%	0.847	78%	0.778	S	S	*	*			trans	120.2	89	159.9	-71.7	-80.3	0	0	0	116.1
171	N	26.9	Very low	29.3	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	78%	0.777	S	S	*	*			trans	-46.2	144.5	143.5	-82.5	-26.9	0	0	0	110.6
172	D	34.7	Very low	29.1	Very low	150 Å²	150	141.8 Å²	141.8	80%	0.802	77%	0.77	S	S	*	*				-161.7	142.5	127.1	-96.1	-31.4	0	0	0	112.7
173	N	28	Very low	28.9	Very low	138 Å²	138	148 Å²	148	74%	0.738	78%	0.777	S	S	*	*			trans	-67.3	136.7	-170.3	-61.1	-71	0	0	0	113.6
174	Y	31.1	Very low	28.8	Very low	233 Å²	233	149.8 Å²	149.8	91%	0.914	77%	0.769	S	S	*	*			trans	-152.1	106.2	146.1	-95.8	-77.2	0	0	0	110.6
175	H	27.3	Very low	28.8	Very low	169 Å²	169	146.3 Å²	146.3	78%	0.782	75%	0.753	S	S	*	*			trans	-103	134.9	152.7	-148	-79.2	0	0	0	105.3	S177	H175-S177 PolarHBondContact ND1-N 3.44Å
176	P	28.1	Very low	28.5	Very low	100 Å²	100	148.8 Å²	148.8	65%	0.649	75%	0.75	S	S	*	*				-145.3	132.4	104.8	24.1	-2.2	0	0	0	112.1
177	S	24.4	Very low	28.6	Very low	86 Å²	86	153.2 Å²	153.2	60%	0.601	75%	0.753	S	S	*	*				36.1	112.1	98.2	60.2	0	0	0	0	114.4	H175	H175-S177 PolarHBondContact ND1-N 3.44Å
178	S	29.7	Very low	28.4	Very low	123 Å²	123	150.6 Å²	150.6	86%	0.86	75%	0.748	S	S	*	*			trans	-178	120.4	134.4	-77.7	0	0	0	0	110.6
179	Q	25.9	Very low	28.2	Very low	175 Å²	175	152.7 Å²	152.7	82%	0.818	75%	0.753	S	S	*	*			trans	-49.6	137.7	163.8	-63.1	161.2	-21.3	0	0	110.7
180	S	30.2	Very low	28.2	Very low	107 Å²	107	151.4 Å²	151.4	75%	0.748	76%	0.757	S	S	*	*			trans	-119.3	86.2	146.4	65.2	0	0	0	0	108	L182	S180-L182 PolarHBondContact O-N 3.4Å
181	N	24.6	Very low	27.8	Very low	139 Å²	139	149.4 Å²	149.4	74%	0.743	75%	0.753	S	S	*	*			trans	-52.1	103.9	149.7	-83.2	-48.8	0	0	0	107.8
182	L	29.7	Very low	27.9	Very low	121 Å²	121	149.9 Å²	149.9	63%	0.634	76%	0.756	S	S	*	*			trans	-113	83.7	158	-91.8	155.9	0	0	0	107.3	S180 F184	S180-L182 PolarHBondContact O-N 3.4Å; L182-F184 VanDerWaalsContact C-N 3.33Å; L182-F184 HydrophobicContact CB-CD2 4.31Å; L182-F184 HydrophobicContact CB-CE2 4.08Å; L182-F184 HydrophobicContact CD2-CE2 4.38Å; L182-F184 HydrophobicContact CD2-CZ 4.45Å; L182-F184 PolarHBondContact O-N 3.23Å
183	R	24.5	Very low	27.5	Very low	243 Å²	243	148.6 Å²	148.6	92%	0.917	75%	0.746	S	S	*	*			trans	-51.1	103.2	147.3	-91.1	-176.9	171.3	-169.4	-2	106.3	G185	R183-G185 VanDerWaalsContact C-N 3.29Å; R183-G185 PolarHBondContact O-N 3.24Å
184	F	29.1	Very low	27.6	Very low	160 Å²	160	150 Å²	150	70%	0.702	75%	0.754	S	S	*	*			trans	-75.8	96.1	159.3	-86.4	-82.2	0	0	0	107	L182	L182-F184 VanDerWaalsContact C-N 3.33Å; L182-F184 HydrophobicContact CB-CD2 4.31Å; L182-F184 HydrophobicContact CB-CE2 4.08Å; L182-F184 HydrophobicContact CD2-CE2 4.38Å; L182-F184 HydrophobicContact CD2-CZ 4.45Å; L182-F184 PolarHBondContact O-N 3.23Å
185	G	26.3	Very low	27.5	Very low	49 Å²	49	146.6 Å²	146.6	51%	0.505	75%	0.746	S	S	.	*			trans	-64.2	160.3	179.1	0	0	0	0	0	112.6	R183 Y187	R183-G185 VanDerWaalsContact C-N 3.29Å; R183-G185 PolarHBondContact O-N 3.24Å; G185-Y187 PolarHBondContact O-N 3.46Å
186	H	25.8	Very low	27.4	Very low	178 Å²	178	144.1 Å²	144.1	82%	0.824	74%	0.743	S	S	*	*			trans	-42.8	120	175	-69.1	-157.9	0	0	0	112.5	N188	H186-N188 VanDerWaalsContact C-N 3.3Å; H186-N188 PolarHBondContact O-N 3.18Å; H186-N188 VanDerWaalsContact O-N 3.13Å
187	Y	28.4	Very low	27.6	Very low	189 Å²	189	146.7 Å²	146.7	74%	0.741	75%	0.751	S	S	*	*			trans	-80	85.3	158.9	-74.1	-79.9	0	0	0	108.5	G185	G185-Y187 PolarHBondContact O-N 3.46Å
188	N	27.1	Very low	27.9	Very low	138 Å²	138	151 Å²	151	74%	0.738	76%	0.762	S	S	*	*			trans	-80.4	112.5	153	-84.7	-21.9	0	0	0	106.6	H186 P190	H186-N188 VanDerWaalsContact C-N 3.3Å; H186-N188 PolarHBondContact O-N 3.18Å; H186-N188 VanDerWaalsContact O-N 3.13Å; N188-P190 VanDerWaalsContact O-CD 3.29Å; N188-P190 WeakPolarHBondContact O-CD 3.21Å
189	Y	28.6	Very low	27.9	Very low	202 Å²	202	151 Å²	151	79%	0.792	76%	0.761	S	S	*	*			trans	-78	115.2	166.5	-93.4	-92.3	0	0	0	108.7	F191	Y189-F191 PolarHBondContact O-N 2.98Å
190	P	27.2	Very low	28.1	Very low	118 Å²	118	150.7 Å²	150.7	77%	0.766	76%	0.762	S	S	*	*			trans	-86.1	106.4	160	28.4	-15.2	0	0	0	107.5	N188 N192	N188-P190 VanDerWaalsContact O-CD 3.29Å; N188-P190 WeakPolarHBondContact O-CD 3.21Å; P190-N192 PolarHBondContact O-N 3.4Å
191	F	26.6	Very low	28.3	Very low	173 Å²	173	152.4 Å²	152.4	76%	0.759	76%	0.762	S	S	*	*			trans	-69.1	109.4	164.4	-132.2	-92.8	0	0	0	106.9	Y189 M193	Y189-F191 PolarHBondContact O-N 2.98Å; F191-M193 HydrophobicContact CD1-CE 4.49Å; F191-M193 HydrophobicContact CD1-CG 4.42Å; F191-M193 HydrophobicContact CE1-CE 3.74Å; F191-M193 HydrophobicContact CE1-CG 4.48Å; F191-M193 HydrophobicContact CE1-SD 4.16Å
192	N	27.7	Very low	28.6	Very low	156 Å²	156	152.1 Å²	152.1	83%	0.834	76%	0.76	S	S	*	*			trans	-130.4	112	159.6	-145.3	-6.4	0	0	0	109.3	P190	P190-N192 PolarHBondContact O-N 3.4Å
193	M	27.2	Very low	28.6	Very low	123 Å²	123	151.1 Å²	151.1	61%	0.606	76%	0.763	S	S	*	*			trans	-66.3	125.7	176.6	-72.8	-73.8	-158.4	0	0	108.9	F191	F191-M193 HydrophobicContact CD1-CE 4.49Å; F191-M193 HydrophobicContact CD1-CG 4.42Å; F191-M193 HydrophobicContact CE1-CE 3.74Å; F191-M193 HydrophobicContact CE1-CG 4.48Å; F191-M193 HydrophobicContact CE1-SD 4.16Å
194	N	30.2	Very low	28.9	Very low	168 Å²	168	147.5 Å²	147.5	90%	0.898	76%	0.757	S	S	*	*			trans	-146.7	95.4	142.6	-96.1	-19.6	0	0	0	107.9
195	Q	28	Very low	29	Very low	162 Å²	162	147.7 Å²	147.7	76%	0.757	76%	0.76	S	S	*	*			trans	-57.9	134.8	158.2	-72.6	172.1	5.6	0	0	108
196	T	26.6	Very low	29.3	Very low	117 Å²	117	153.6 Å²	153.6	72%	0.718	77%	0.768	S	S	*	*				172	130.2	123.2	38.6	0	0	0	0	109.9
197	N	32	Very low	29.5	Very low	153 Å²	153	153.4 Å²	153.4	82%	0.818	77%	0.768	S	S	*	*	S	Bend	trans	97.8	1.2	150.5	-55.4	-19.9	0	0	0	123.4
198	E	31	Very low	29.6	Very low	176 Å²	176	151.8 Å²	151.8	82%	0.822	77%	0.772	S	S	*	*			trans	-107.4	-5.7	179.1	-69.7	-169.1	161.3	0	0	116.7	M200	E198-M200 PolarHBondContact O-N 3.47Å
199	C	28.4	Very low	29.6	Very low	124 Å²	124	151.6 Å²	151.6	84%	0.838	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	4.7	-176	-89	0	0	0	0	116.6
200	M	32.1	Very low	29.8	Very low	169 Å²	169	148.3 Å²	148.3	83%	0.833	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-11.9	-177.2	-84.5	-91.7	-149.3	0	0	114.9	E198	E198-M200 PolarHBondContact O-N 3.47Å
201	N	33.4	Very low	30	Very low	142 Å²	142	148.7 Å²	148.7	76%	0.759	77%	0.769	S	S	*	*	S	Bend	trans	-104.2	-10.4	-172.7	-92.2	-35.2	0	0	0	116
202	L	30.6	Very low	30.4	Very low	133 Å²	133	147.3 Å²	147.3	70%	0.696	77%	0.769	S	S	*	*	S	Bend	trans	-90.3	-12.2	178.5	-92.4	88.8	0	0	0	114.6	Q204	L202-Q204 VanDerWaalsContact C-N 3.33Å; L202-Q204 PolarHBondContact O-N 2.94Å
203	S	30.2	Very low	30.8	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-1.3	-176.1	-65.8	0	0	0	0	115.1
204	Q	30.7	Very low	31.1	Very low	167 Å²	167	140.6 Å²	140.6	78%	0.78	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-3.8	-179.1	-68.8	-170.4	26.6	0	0	114.9	L202	L202-Q204 VanDerWaalsContact C-N 3.33Å; L202-Q204 PolarHBondContact O-N 2.94Å
205	Q	31.6	Very low	31.4	Very low	164 Å²	164	136.9 Å²	136.9	77%	0.766	73%	0.733	S	S	*	*	S	Bend	trans	-99.2	0.2	-176.6	-98.3	-171.1	-20.2	0	0	116.1
206	Y	31.3	Very low	32	Very low	172 Å²	172	137.1 Å²	137.1	68%	0.675	73%	0.727	S	S	*	*			trans	-126.3	26	-169.9	-73	-77.7	0	0	0	115.8	N208	Y206-N208 VanDerWaalsContact C-N 3.33Å; Y206-N208 PolarHBondContact O-N 2.95Å
207	Q	30.1	Very low	32.7	Very low	175 Å²	175	133 Å²	133	82%	0.818	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	8.7	176.8	-93.1	-175.8	-20.8	0	0	115.9
208	N	30	Very low	33.1	Very low	154 Å²	154	131.6 Å²	131.6	82%	0.824	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	24.8	-171.2	-76.2	-29.1	0	0	0	116.5	Y206	Y206-N208 VanDerWaalsContact C-N 3.33Å; Y206-N208 PolarHBondContact O-N 2.95Å
209	N	29.1	Very low	34	Very low	134 Å²	134	128.5 Å²	128.5	72%	0.717	68%	0.675	S	S	*	*			trans	-114.9	97.7	178.6	-73.6	-35.4	0	0	0	112.4
210	D	32.5	Very low	35.2	Very low	134 Å²	134	129.8 Å²	129.8	72%	0.717	67%	0.667	S	S	*	*			trans	-49.7	134.4	173.5	-91.2	-43.1	0	0	0	113	L212	D210-L212 PolarHBondContact O-N 3.41Å
211	P	31.2	Very low	36.2	Very low	126 Å²	126	123 Å²	123	82%	0.818	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	27.7	-177.7	30	-33.3	0	0	0	114.9
212	L	34.7	Very low	37	Very low	143 Å²	143	120 Å²	120	75%	0.749	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	16	-166	-89.6	162.5	0	0	0	116.9	D210	D210-L212 PolarHBondContact O-N 3.41Å
213	N	35.7	Very low	38.2	Very low	95 Å²	95	120.1 Å²	120.1	51%	0.508	62%	0.615	S	S	.	*			trans	-101.6	4	-174	-92.1	-25.3	0	0	0	117.2	S215 R216	N213-S215 VanDerWaalsContact C-N 3.3Å; N213-S215 PolarHBondContact O-N 2.93Å; N213-R216 PolarHBondContact O-N 3.41Å; N213-R216 WeakPolarHBondContact OD1-CD 3.09Å
214	G	32.8	Very low	39.3	Very low	44 Å²	44	119.4 Å²	119.4	45%	0.454	60%	0.603	S	S	.	*	H	α-helix	trans	-66.2	-26.1	179.3	0	0	0	0	0	114.9	S217	G214-S217 PolarHBondContact O-OG 3.06Å
215	S	38.2	Very low	40.3	Very low	89 Å²	89	116.2 Å²	116.2	62%	0.622	59%	0.589	S	S	*	*	H	α-helix	trans	-83.7	-24.9	-178.7	-55.8	0	0	0	0	113.6	N213 E219	N213-S215 VanDerWaalsContact C-N 3.3Å; N213-S215 PolarHBondContact O-N 2.93Å; S215-E219 PolarHBondContact O-N 3.29Å
216	R	39.8	Very low	41.2	Very low	168 Å²	168	113.7 Å²	113.7	63%	0.634	58%	0.581	S	S	*	*	H	α-helix	trans	-77.4	-26	-175.6	-73.3	-173.1	178.1	172.8	-4.5	113.6	N213 K220	N213-R216 PolarHBondContact O-N 3.41Å; N213-R216 WeakPolarHBondContact OD1-CD 3.09Å; R216-K220 PolarHBondContact O-N 3.06Å
217	S	40.4	Very low	42.1	Very low	29 Å²	29	112.1 Å²	112.1	20%	0.203	58%	0.584	C	S	.	*	H	α-helix	trans	-72.6	-38.2	176.8	40.3	0	0	0	0	112	G214 K220 I221	G214-S217 PolarHBondContact O-OG 3.06Å; S217-K220 PolarHBondContact O-N 3.31Å; S217-I221 PolarHBondContact O-N 3.48Å
218	F	41.4	Very low	43	Very low	124 Å²	124	108.4 Å²	108.4	54%	0.544	57%	0.57	S	S	.	*	H	α-helix	trans	-70	-37.7	174.1	-81.6	-81	0	0	0	112.8	K220 I221 T222	F218-K220 VanDerWaalsContact C-N 3.28Å; F218-K220 PolarHBondContact O-N 3.13Å; F218-I221 WeakPolarHBondContact O-CB 3.42Å; F218-I221 PolarHBondContact O-N 2.88Å; F218-I221 VanDerWaalsContact O-N 3.11Å; F218-T222 PolarHBondContact O-N 3.25Å; F218-T222 PolarHBondContact O-OG1 2.75Å
219	E	50.1	Low	43.8	Very low	111 Å²	111	107.2 Å²	107.2	52%	0.519	56%	0.563	S	S	.	*	H	α-helix	trans	-60.9	-34.4	172.9	-84.2	-172.8	155.8	0	0	113.3	S215 I221 T222 K223	S215-E219 PolarHBondContact O-N 3.29Å; E219-I221 VanDerWaalsContact C-N 3.33Å; E219-T222 PolarHBondContact O-N 2.9Å; E219-K223 WeakPolarHBondContact O-CB 3.42Å; E219-K223 VanDerWaalsContact O-CG 3.3Å; E219-K223 WeakPolarHBondContact O-CG 3.3Å; E219-K223 PolarHBondContact O-N 2.97Å
220	K	54.2	Low	44.5	Very low	152 Å²	152	107.3 Å²	107.3	66%	0.661	56%	0.564	S	S	*	*	H	α-helix	trans	-64.3	-39.1	174	-79.4	-178.7	178	-177.9	0	111.7	R216 S217 F218 K223 I224	R216-K220 PolarHBondContact O-N 3.06Å; S217-K220 PolarHBondContact O-N 3.31Å; F218-K220 VanDerWaalsContact C-N 3.28Å; F218-K220 PolarHBondContact O-N 3.13Å; K220-K223 PolarHBondContact O-N 2.83Å; K220-I224 WeakPolarHBondContact O-CG1 3.49Å; K220-I224 PolarHBondContact O-N 3.31Å
221	I	51.2	Low	44.7	Very low	26 Å²	26	108 Å²	108	13%	0.133	57%	0.567	C	S	.	*	H	α-helix	trans	-66.7	-42.3	177.6	-65	168.7	0	0	0	110.4	S217 F218 E219 K223 I224 M225	S217-I221 PolarHBondContact O-N 3.48Å; F218-I221 WeakPolarHBondContact O-CB 3.42Å; F218-I221 PolarHBondContact O-N 2.88Å; F218-I221 VanDerWaalsContact O-N 3.11Å; E219-I221 VanDerWaalsContact C-N 3.33Å; I221-K223 PolarHBondContact O-N 3.47Å; I221-I224 PolarHBondContact O-N 2.85Å; I221-M225 HydrophobicContact CG2-CE 3.83Å; I221-M225 PolarHBondContact O-N 3.42Å
222	T	51.1	Low	45.2	Very low	78 Å²	78	107.9 Å²	107.9	48%	0.479	56%	0.559	S	S	.	*	H	α-helix	trans	-66.6	-35.9	177.3	-42.5	0	0	0	0	112.6	F218 E219 M225 N226	F218-T222 PolarHBondContact O-N 3.25Å; F218-T222 PolarHBondContact O-OG1 2.75Å; E219-T222 PolarHBondContact O-N 2.9Å; T222-M225 PolarHBondContact O-N 3.24Å; T222-N226 PolarHBondContact O-N 3.38Å
223	K	55.9	Low	45.4	Very low	137 Å²	137	107.8 Å²	107.8	60%	0.596	56%	0.559	S	S	*	*	H	α-helix	trans	-68	-33.1	176.8	-77	173.5	-178.7	174	0	113.2	E219 K220 I221 M225 N226 N227	E219-K223 WeakPolarHBondContact O-CB 3.42Å; E219-K223 VanDerWaalsContact O-CG 3.3Å; E219-K223 WeakPolarHBondContact O-CG 3.3Å; E219-K223 PolarHBondContact O-N 2.97Å; K220-K223 PolarHBondContact O-N 2.83Å; I221-K223 PolarHBondContact O-N 3.47Å; K223-M225 VanDerWaalsContact C-N 3.32Å; K223-N226 PolarHBondContact O-N 3.01Å; K223-N227 PolarHBondContact O-N 3.47Å
224	I	54.2	Low	45.5	Very low	86 Å²	86	109.5 Å²	109.5	44%	0.441	57%	0.573	S	S	.	*	H	α-helix	trans	-67.9	-33.6	174.9	-66.9	165.4	0	0	0	111	K220 I221	K220-I224 WeakPolarHBondContact O-CG1 3.49Å; K220-I224 PolarHBondContact O-N 3.31Å; I221-I224 PolarHBondContact O-N 2.85Å
225	M	50	Low	46.1	Very low	99 Å²	99	113.8 Å²	113.8	49%	0.488	59%	0.59	S	S	.	*	H	α-helix	trans	-73.4	-32.9	177	-67.1	-175.3	-160.9	0	0	113.5	I221 T222 K223 N229 I248	I221-M225 HydrophobicContact CG2-CE 3.83Å; I221-M225 PolarHBondContact O-N 3.42Å; T222-M225 PolarHBondContact O-N 3.24Å; K223-M225 VanDerWaalsContact C-N 3.32Å; M225-N229 PolarHBondContact O-ND2 3.37Å; M225-I248 HydrophobicContact CE-CD1 4.16Å
226	N	50.4	Low	46.3	Very low	112 Å²	112	116.9 Å²	116.9	60%	0.599	60%	0.595	S	S	*	*	H	α-helix	trans	-83	-24.6	-176.1	-84	-8.7	0	0	0	114.6	T222 K223	T222-N226 PolarHBondContact O-N 3.38Å; K223-N226 PolarHBondContact O-N 3.01Å
227	N	50	Low	46.7	Very low	138 Å²	138	111.1 Å²	111.1	74%	0.738	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-12.1	-177.5	-98.2	3.1	0	0	0	115.1	K223	K223-N227 PolarHBondContact O-N 3.47Å
228	N	49	Very low	47	Very low	98 Å²	98	114 Å²	114	52%	0.524	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.9	6.9	-175.5	-71.9	-14.9	0	0	0	114.3	N230	N228-N230 VanDerWaalsContact C-N 3.33Å
229	N	46.8	Very low	47.6	Very low	128 Å²	128	113.7 Å²	113.7	68%	0.684	61%	0.605	S	S	*	*	S	Bend	trans	-87.4	2.5	178.9	-80.9	-22.7	0	0	0	114.2	M225	M225-N229 PolarHBondContact O-ND2 3.37Å
230	N	44.5	Very low	48.4	Very low	136 Å²	136	112 Å²	112	73%	0.727	60%	0.6	S	S	*	*	S	Bend	trans	-122.4	114.1	175	-64.5	-34.8	0	0	0	108.3	N228	N228-N230 VanDerWaalsContact C-N 3.33Å
231	N	37.2	Very low	48.9	Very low	148 Å²	148	110.3 Å²	110.3	79%	0.791	59%	0.594	S	S	*	*			trans	75.4	113.1	-171.7	-60.7	-26.3	0	0	0	114.6
232	I	41.4	Very low	49.6	Very low	124 Å²	124	111.3 Å²	111.3	64%	0.636	60%	0.599	S	S	*	*				-177.7	123.2	129.2	-86.5	146	0	0	0	108.7
233	D	38.4	Very low	50.8	Low	142 Å²	142	113 Å²	113	76%	0.759	60%	0.602	S	S	*	*			trans	-57.9	149	177.5	-77.5	-55.1	0	0	0	114.6	T235	D233-T235 PolarHBondContact O-N 2.92Å
234	T	38.3	Very low	51.9	Low	130 Å²	130	109.3 Å²	109.3	80%	0.798	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	23	-151.3	-9.6	0	0	0	0	117.7
235	T	44.7	Very low	52.6	Low	134 Å²	134	106.9 Å²	106.9	82%	0.822	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	-14.4	-179.2	49.3	0	0	0	0	115.8	D233	D233-T235 PolarHBondContact O-N 2.92Å
236	Q	43.1	Very low	54	Low	154 Å²	154	108.1 Å²	108.1	72%	0.72	58%	0.581	S	S	*	*	S	Bend	trans	-97.5	-4.7	167.5	-72.5	-175	-12.9	0	0	113.2
237	S	48	Very low	55.3	Low	48 Å²	48	108.4 Å²	108.4	34%	0.336	58%	0.579	S	S	.	*	H	α-helix	trans	-71.3	-32.3	-172.7	178.6	0	0	0	0	114.2	N239 N240 H241	S237-N239 PolarHBondContact O-N 3.35Å; S237-N240 PolarHBondContact O-N 3.04Å; S237-H241 VanDerWaalsContact O-CB 3.32Å; S237-H241 WeakPolarHBondContact O-CB 3.45Å; S237-H241 PolarHBondContact O-N 2.94Å
238	S	46.2	Very low	56.7	Low	88 Å²	88	104 Å²	104	62%	0.615	56%	0.555	S	S	*	*	H	α-helix	trans	-66.8	-40.3	-172.9	67.5	0	0	0	0	113.8	H241 D242	S238-H241 PolarHBondContact O-N 2.85Å; S238-D242 PolarHBondContact O-N 3.41Å; S238-D242 VanDerWaalsContact O-N 3.12Å
239	N	54.9	Low	58.1	Low	119 Å²	119	103 Å²	103	64%	0.636	55%	0.549	S	S	*	.	H	α-helix	trans	-70.4	-38.5	176.8	-74.1	-21.2	0	0	0	111.8	S237 Q243	S237-N239 PolarHBondContact O-N 3.35Å; N239-Q243 WeakPolarHBondContact O-CB 3.32Å; N239-Q243 VanDerWaalsContact O-CG 3.3Å; N239-Q243 WeakPolarHBondContact O-CG 3.4Å; N239-Q243 PolarHBondContact O-N 3.22Å
240	N	66.3	Low	59.8	Low	76 Å²	76	103.5 Å²	103.5	41%	0.406	55%	0.545	S	S	.	.	H	α-helix	trans	-67.3	-39.4	175.7	-78.3	-13.2	0	0	0	111.4	S237 Q243 I244	S237-N240 PolarHBondContact O-N 3.04Å; N240-Q243 PolarHBondContact O-N 3.07Å; N240-I244 WeakPolarHBondContact O-CB 3.32Å; N240-I244 WeakPolarHBondContact O-CD1 3.42Å; N240-I244 WeakPolarHBondContact O-CG1 3.28Å; N240-I244 PolarHBondContact O-N 3.1Å
241	H	65.4	Low	61.4	Low	116 Å²	116	100.4 Å²	100.4	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-67.6	-39.6	179.6	-151.4	-51.1	0	0	0	111.9	S237 S238 I244 C245	S237-H241 VanDerWaalsContact O-CB 3.32Å; S237-H241 WeakPolarHBondContact O-CB 3.45Å; S237-H241 PolarHBondContact O-N 2.94Å; S238-H241 PolarHBondContact O-N 2.85Å; H241-I244 PolarHBondContact O-N 3.24Å; H241-C245 WeakPolarHBondContact O-CB 3.4Å; H241-C245 PolarHBondContact O-N 3.39Å; H241-C245 PolarHBondContact O-SG 3.35Å
242	D	66.5	Low	63.5	Low	47 Å²	47	95.9 Å²	95.9	25%	0.251	50%	0.503	S	S	.	.	H	α-helix	trans	-68.5	-37.5	174.8	-168.9	47.2	0	0	0	111.8	C137 S238 C245 K246	C137-D242 WeakPolarHBondContact CB-OD1 3.5Å; C137-D242 PolarHBondContact SG-OD1 2.96Å; S238-D242 PolarHBondContact O-N 3.41Å; S238-D242 VanDerWaalsContact O-N 3.12Å; D242-C245 PolarHBondContact O-N 3.44Å; D242-K246 WeakPolarHBondContact O-CB 3.28Å; D242-K246 VanDerWaalsContact O-CG 3.3Å; D242-K246 WeakPolarHBondContact O-CG 3.49Å; D242-K246 PolarHBondContact O-N 3.46Å; D242-K246 VanDerWaalsContact OD2-CE 3.27Å; D242-K246 WeakPolarHBondContact OD2-CE 3.5Å; D242-K246 IonicContact OD2-NZ 2.92Å; D242-K246 PolarHBondContact OD2-NZ 3.07Å
243	Q	75.8	Confident	65.4	Low	113 Å²	113	97.7 Å²	97.7	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-43.1	172.1	-75.8	-176	10.8	0	0	112.3	N239 N240 K246 Q247	N239-Q243 WeakPolarHBondContact O-CB 3.32Å; N239-Q243 VanDerWaalsContact O-CG 3.3Å; N239-Q243 WeakPolarHBondContact O-CG 3.4Å; N239-Q243 PolarHBondContact O-N 3.22Å; N240-Q243 PolarHBondContact O-N 3.07Å; Q243-K246 PolarHBondContact O-N 2.86Å; Q243-Q247 WeakPolarHBondContact O-CB 3.31Å; Q243-Q247 WeakPolarHBondContact O-CG 3.43Å; Q243-Q247 PolarHBondContact O-N 2.86Å
244	I	78.3	Confident	67.4	Low	59 Å²	59	96 Å²	96	30%	0.303	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-45.5	175.7	-70.1	163.5	0	0	0	110.1	N240 H241 K246 Q247 I248	N240-I244 WeakPolarHBondContact O-CB 3.32Å; N240-I244 WeakPolarHBondContact O-CD1 3.42Å; N240-I244 WeakPolarHBondContact O-CG1 3.28Å; N240-I244 PolarHBondContact O-N 3.1Å; H241-I244 PolarHBondContact O-N 3.24Å; I244-K246 VanDerWaalsContact C-N 3.34Å; I244-K246 PolarHBondContact O-N 3.42Å; I244-Q247 PolarHBondContact O-N 2.94Å; I244-Q247 VanDerWaalsContact O-N 3.17Å; I244-I248 HydrophobicContact CG2-CD1 3.7Å; I244-I248 HydrophobicContact CG2-CG1 4.33Å; I244-I248 VanDerWaalsContact O-CG1 3.29Å; I244-I248 WeakPolarHBondContact O-CG1 3.37Å; I244-I248 PolarHBondContact O-N 2.93Å
245	C	69.8	Low	69.2	Low	35 Å²	35	92 Å²	92	24%	0.236	46%	0.462	C	S	.	.	H	α-helix	trans	-59	-44.5	175.5	-74	0	0	0	0	111.5	H241 D242 Q247 I248 L249	H241-C245 WeakPolarHBondContact O-CB 3.4Å; H241-C245 PolarHBondContact O-N 3.39Å; H241-C245 PolarHBondContact O-SG 3.35Å; D242-C245 PolarHBondContact O-N 3.44Å; C245-Q247 PolarHBondContact O-N 3.08Å; C245-I248 PolarHBondContact O-N 3.3Å; C245-L249 WeakPolarHBondContact O-CB 3.18Å; C245-L249 WeakPolarHBondContact O-CG 3.33Å; C245-L249 PolarHBondContact O-N 3.43Å
246	K	79	Confident	70.7	Confident	125 Å²	125	86.9 Å²	86.9	54%	0.543	43%	0.429	S	S	.	.	H	α-helix	trans	-62.6	-39.4	174.8	-76.5	167.9	175.5	159.9	0	112.6	D242 Q243 I244 K250	D242-K246 WeakPolarHBondContact O-CB 3.28Å; D242-K246 VanDerWaalsContact O-CG 3.3Å; D242-K246 WeakPolarHBondContact O-CG 3.49Å; D242-K246 PolarHBondContact O-N 3.46Å; D242-K246 VanDerWaalsContact OD2-CE 3.27Å; D242-K246 WeakPolarHBondContact OD2-CE 3.5Å; D242-K246 IonicContact OD2-NZ 2.92Å; D242-K246 PolarHBondContact OD2-NZ 3.07Å; Q243-K246 PolarHBondContact O-N 2.86Å; I244-K246 VanDerWaalsContact C-N 3.34Å; I244-K246 PolarHBondContact O-N 3.42Å; K246-K250 WeakPolarHBondContact O-CB 3.34Å; K246-K250 PolarHBondContact O-N 3.37Å
247	Q	77.8	Confident	72.7	Confident	119 Å²	119	83.4 Å²	83.4	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-65.9	-44.2	175.5	-75.6	179.5	12.1	0	0	111.9	Q243 I244 C245 K250 Q251	Q243-Q247 WeakPolarHBondContact O-CB 3.31Å; Q243-Q247 WeakPolarHBondContact O-CG 3.43Å; Q243-Q247 PolarHBondContact O-N 2.86Å; I244-Q247 PolarHBondContact O-N 2.94Å; I244-Q247 VanDerWaalsContact O-N 3.17Å; C245-Q247 PolarHBondContact O-N 3.08Å; Q247-K250 WeakPolarHBondContact O-CB 3.48Å; Q247-K250 PolarHBondContact O-N 2.88Å; Q247-Q251 PolarHBondContact O-N 3.02Å
248	I	79.6	Confident	74.3	Confident	46 Å²	46	85.9 Å²	85.9	24%	0.236	42%	0.417	C	S	.	.	H	α-helix	trans	-61.8	-47.2	175.7	-67.8	166.1	0	0	0	109.9	M225 I244 C245 K250 Q251 V252	M225-I248 HydrophobicContact CE-CD1 4.16Å; I244-I248 HydrophobicContact CG2-CD1 3.7Å; I244-I248 HydrophobicContact CG2-CG1 4.33Å; I244-I248 VanDerWaalsContact O-CG1 3.29Å; I244-I248 WeakPolarHBondContact O-CG1 3.37Å; I244-I248 PolarHBondContact O-N 2.93Å; C245-I248 PolarHBondContact O-N 3.3Å; I248-K250 VanDerWaalsContact C-N 3.29Å; I248-K250 PolarHBondContact O-N 3.34Å; I248-Q251 PolarHBondContact O-N 2.99Å; I248-Q251 VanDerWaalsContact O-N 3.17Å; I248-V252 HydrophobicContact CG2-CG2 4.2Å; I248-V252 WeakPolarHBondContact O-CB 3.3Å; I248-V252 VanDerWaalsContact O-CG2 3.31Å; I248-V252 WeakPolarHBondContact O-CG2 3.35Å; I248-V252 PolarHBondContact O-N 2.81Å
249	L	78.1	Confident	75.9	Confident	77 Å²	77	86.3 Å²	86.3	40%	0.403	41%	0.411	S	S	.	.	H	α-helix	trans	-59.5	-40.4	176.9	-73.9	167.4	0	0	0	111.8	I132 C245 R253	I132-L249 HydrophobicContact CG2-CD2 3.32Å; C245-L249 WeakPolarHBondContact O-CB 3.18Å; C245-L249 WeakPolarHBondContact O-CG 3.33Å; C245-L249 PolarHBondContact O-N 3.43Å; L249-R253 VanDerWaalsContact O-CB 3.25Å; L249-R253 WeakPolarHBondContact O-CB 3.34Å; L249-R253 PolarHBondContact O-N 2.92Å
250	K	81.8	Confident	77.3	Confident	137 Å²	137	82.1 Å²	82.1	60%	0.596	39%	0.389	S	S	*	.	H	α-helix	trans	-63.6	-44.3	175.2	-173	180	179	-177.6	0	111.6	K246 Q247 I248 R253 Q254	K246-K250 WeakPolarHBondContact O-CB 3.34Å; K246-K250 PolarHBondContact O-N 3.37Å; Q247-K250 WeakPolarHBondContact O-CB 3.48Å; Q247-K250 PolarHBondContact O-N 2.88Å; I248-K250 VanDerWaalsContact C-N 3.29Å; I248-K250 PolarHBondContact O-N 3.34Å; K250-R253 PolarHBondContact O-N 3.11Å; K250-Q254 VanDerWaalsContact O-CG 3.3Å; K250-Q254 WeakPolarHBondContact O-CG 3.35Å; K250-Q254 PolarHBondContact O-N 3.03Å
251	Q	79.5	Confident	78.1	Confident	71 Å²	71	83 Å²	83	33%	0.332	39%	0.394	S	S	.	.	H	α-helix	trans	-65.4	-45.9	177.2	-77.9	179.6	-9.8	0	0	112.2	Q247 I248 R253 Q254 E255	Q247-Q251 PolarHBondContact O-N 3.02Å; I248-Q251 PolarHBondContact O-N 2.99Å; I248-Q251 VanDerWaalsContact O-N 3.17Å; Q251-R253 VanDerWaalsContact C-N 3.3Å; Q251-R253 PolarHBondContact O-N 2.65Å; Q251-Q254 PolarHBondContact O-N 3.3Å; Q251-E255 PolarHBondContact O-N 2.94Å
252	V	80.7	Confident	79	Confident	53 Å²	53	81.1 Å²	81.1	32%	0.321	39%	0.387	S	S	.	.	H	α-helix	trans	-60.2	-43	176.9	171.1	0	0	0	0	110.6	I132 I248 E255 M256	I132-V252 HydrophobicContact CD1-CG1 4.37Å; I248-V252 HydrophobicContact CG2-CG2 4.2Å; I248-V252 WeakPolarHBondContact O-CB 3.3Å; I248-V252 VanDerWaalsContact O-CG2 3.31Å; I248-V252 WeakPolarHBondContact O-CG2 3.35Å; I248-V252 PolarHBondContact O-N 2.81Å; V252-E255 PolarHBondContact O-N 3.48Å; V252-M256 WeakPolarHBondContact O-CB 3.42Å; V252-M256 PolarHBondContact O-N 3.37Å
253	R	80.4	Confident	79.6	Confident	163 Å²	163	80.6 Å²	80.6	62%	0.615	39%	0.388	S	S	*	.	H	α-helix	trans	-62.2	-43.1	175.8	-176.4	176.5	179.3	165.8	0.4	112.1	L249 K250 Q251 M256 I257	L249-R253 VanDerWaalsContact O-CB 3.25Å; L249-R253 WeakPolarHBondContact O-CB 3.34Å; L249-R253 PolarHBondContact O-N 2.92Å; K250-R253 PolarHBondContact O-N 3.11Å; Q251-R253 VanDerWaalsContact C-N 3.3Å; Q251-R253 PolarHBondContact O-N 2.65Å; R253-M256 PolarHBondContact O-N 3.36Å; R253-I257 HydrophobicContact CG-CD1 4.08Å; R253-I257 VanDerWaalsContact O-CG1 3.32Å; R253-I257 WeakPolarHBondContact O-CG1 3.37Å; R253-I257 PolarHBondContact O-N 3.28Å
254	Q	80.7	Confident	79.6	Confident	106 Å²	106	79 Å²	79	50%	0.495	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-44.1	177.4	-76.8	174.4	-18.9	0	0	112	K250 Q251 M256 I257 R258	K250-Q254 VanDerWaalsContact O-CG 3.3Å; K250-Q254 WeakPolarHBondContact O-CG 3.35Å; K250-Q254 PolarHBondContact O-N 3.03Å; Q251-Q254 PolarHBondContact O-N 3.3Å; Q254-M256 VanDerWaalsContact C-N 3.33Å; Q254-M256 PolarHBondContact O-N 3.41Å; Q254-I257 PolarHBondContact O-N 3.05Å; Q254-R258 WeakPolarHBondContact O-CB 3.35Å; Q254-R258 PolarHBondContact O-N 3.28Å
255	E	76.9	Confident	79.8	Confident	45 Å²	45	81.7 Å²	81.7	21%	0.21	39%	0.392	C	S	.	.	H	α-helix	trans	-64.4	-38.6	176.3	-76.3	-59	135.6	0	0	112	Q251 V252 R258 L259	Q251-E255 PolarHBondContact O-N 2.94Å; V252-E255 PolarHBondContact O-N 3.48Å; E255-R258 PolarHBondContact O-N 2.92Å; E255-R258 IonicContact OE1-NE 2.83Å; E255-R258 IonicContact OE2-CZ 3.18Å; E255-R258 VanDerWaalsContact OE2-CZ 3.28Å; E255-R258 IonicContact OE2-NE 3.39Å; E255-R258 PolarHBondContact OE2-NE 2.96Å; E255-R258 IonicContact OE2-NH2 3.17Å; E255-R258 PolarHBondContact OE2-NH2 3.37Å; E255-L259 WeakPolarHBondContact O-CB 3.49Å; E255-L259 VanDerWaalsContact O-CG 3.28Å; E255-L259 WeakPolarHBondContact O-CG 3.11Å; E255-L259 PolarHBondContact O-N 3.06Å
256	M	76.6	Confident	80.1	Confident	28 Å²	28	85.7 Å²	85.7	14%	0.138	41%	0.407	C	S	.	.	H	α-helix	trans	-64.9	-43.4	177.1	-165.9	178.2	-68.1	0	0	112	A129 I132 V252 R253 Q254 L259 I260	A129-M256 HydrophobicContact CB-SD 3.32Å; A129-M256 WeakPolarHBondContact CB-SD 3.5Å; I132-M256 HydrophobicContact CD1-CE 3.76Å; V252-M256 WeakPolarHBondContact O-CB 3.42Å; V252-M256 PolarHBondContact O-N 3.37Å; R253-M256 PolarHBondContact O-N 3.36Å; Q254-M256 VanDerWaalsContact C-N 3.33Å; Q254-M256 PolarHBondContact O-N 3.41Å; M256-L259 PolarHBondContact O-N 3.45Å; M256-I260 HydrophobicContact CG-CD1 4.35Å; M256-I260 VanDerWaalsContact O-CG1 3.3Å; M256-I260 WeakPolarHBondContact O-CG1 3.34Å; M256-I260 PolarHBondContact O-N 3.43Å
257	I	84.2	Confident	79.9	Confident	81 Å²	81	81.1 Å²	81.1	42%	0.415	39%	0.389	S	S	.	.	H	α-helix	trans	-60.9	-47.5	174.2	-68	166.2	0	0	0	110.1	R253 Q254 L259 I260 D261	R253-I257 HydrophobicContact CG-CD1 4.08Å; R253-I257 VanDerWaalsContact O-CG1 3.32Å; R253-I257 WeakPolarHBondContact O-CG1 3.37Å; R253-I257 PolarHBondContact O-N 3.28Å; Q254-I257 PolarHBondContact O-N 3.05Å; I257-L259 VanDerWaalsContact C-N 3.29Å; I257-L259 PolarHBondContact O-N 2.9Å; I257-I260 WeakPolarHBondContact O-CB 3.47Å; I257-I260 PolarHBondContact O-N 3.3Å; I257-I260 VanDerWaalsContact O-N 3.08Å; I257-D261 PolarHBondContact O-N 3.07Å
258	R	82	Confident	79.7	Confident	100 Å²	100	80.9 Å²	80.9	38%	0.377	39%	0.388	S	S	.	.	H	α-helix	trans	-57.8	-40.1	178	-171.2	-177.8	74.5	98.2	1.3	112.6	Q254 E255 N262	Q254-R258 WeakPolarHBondContact O-CB 3.35Å; Q254-R258 PolarHBondContact O-N 3.28Å; E255-R258 PolarHBondContact O-N 2.92Å; E255-R258 IonicContact OE1-NE 2.83Å; E255-R258 IonicContact OE2-CZ 3.18Å; E255-R258 VanDerWaalsContact OE2-CZ 3.28Å; E255-R258 IonicContact OE2-NE 3.39Å; E255-R258 PolarHBondContact OE2-NE 2.96Å; E255-R258 IonicContact OE2-NH2 3.17Å; E255-R258 PolarHBondContact OE2-NH2 3.37Å; R258-N262 WeakPolarHBondContact O-CB 3.23Å; R258-N262 VanDerWaalsContact O-CG 3.28Å; R258-N262 PolarHBondContact O-N 3.3Å
259	L	79.1	Confident	79.6	Confident	96 Å²	96	81.3 Å²	81.3	50%	0.503	39%	0.392	S	S	.	.	H	α-helix	trans	-67.3	-40.2	176.4	-73.5	171.1	0	0	0	112	E255 M256 I257 S263	E255-L259 WeakPolarHBondContact O-CB 3.49Å; E255-L259 VanDerWaalsContact O-CG 3.28Å; E255-L259 WeakPolarHBondContact O-CG 3.11Å; E255-L259 PolarHBondContact O-N 3.06Å; M256-L259 PolarHBondContact O-N 3.45Å; I257-L259 VanDerWaalsContact C-N 3.29Å; I257-L259 PolarHBondContact O-N 2.9Å; L259-S263 WeakPolarHBondContact O-CB 3.4Å; L259-S263 PolarHBondContact O-N 2.86Å; L259-S263 PolarHBondContact O-OG 2.99Å
260	I	84.5	Confident	79.3	Confident	32 Å²	32	81.8 Å²	81.8	16%	0.164	39%	0.389	C	S	.	.	H	α-helix	trans	-62.9	-50.7	175.1	-68.5	165.4	0	0	0	109.8	M256 I257 N262 S263 M264	M256-I260 HydrophobicContact CG-CD1 4.35Å; M256-I260 VanDerWaalsContact O-CG1 3.3Å; M256-I260 WeakPolarHBondContact O-CG1 3.34Å; M256-I260 PolarHBondContact O-N 3.43Å; I257-I260 WeakPolarHBondContact O-CB 3.47Å; I257-I260 PolarHBondContact O-N 3.3Å; I257-I260 VanDerWaalsContact O-N 3.08Å; I260-N262 VanDerWaalsContact C-N 3.33Å; I260-N262 PolarHBondContact O-N 3.45Å; I260-S263 PolarHBondContact O-N 3.43Å; I260-S263 PolarHBondContact O-OG 3.03Å; I260-M264 HydrophobicContact CG2-CG 4.28Å; I260-M264 WeakPolarHBondContact O-CG 3.42Å; I260-M264 PolarHBondContact O-N 3.37Å
261	D	82.5	Confident	78.8	Confident	95 Å²	95	79.3 Å²	79.3	51%	0.508	38%	0.382	S	S	.	.	H	α-helix	trans	-59.6	-43.3	-179.9	-68	-19	0	0	0	111.6	I257 S263 M264 H265	I257-D261 PolarHBondContact O-N 3.07Å; D261-S263 VanDerWaalsContact C-N 3.34Å; D261-S263 PolarHBondContact O-N 3.05Å; D261-M264 PolarHBondContact O-N 2.85Å; D261-H265 WeakPolarHBondContact O-CB 3.31Å; D261-H265 PolarHBondContact O-N 2.68Å
262	N	84.3	Confident	78.4	Confident	75 Å²	75	83.4 Å²	83.4	40%	0.401	40%	0.401	S	S	.	.	H	α-helix	trans	-61	-41.7	174.3	-80.2	-9	0	0	0	112.3	R258 I260 Q266	R258-N262 WeakPolarHBondContact O-CB 3.23Å; R258-N262 VanDerWaalsContact O-CG 3.28Å; R258-N262 PolarHBondContact O-N 3.3Å; I260-N262 VanDerWaalsContact C-N 3.33Å; I260-N262 PolarHBondContact O-N 3.45Å; N262-Q266 VanDerWaalsContact O-CG 3.31Å; N262-Q266 WeakPolarHBondContact O-CG 3.31Å; N262-Q266 PolarHBondContact O-N 3.3Å
263	S	79.4	Confident	77.6	Confident	37 Å²	37	86.8 Å²	86.8	26%	0.259	42%	0.417	S	S	.	.	H	α-helix	trans	-67.7	-38.6	178.1	73.2	0	0	0	0	112.1	L259 I260 D261 Q266 L267	L259-S263 WeakPolarHBondContact O-CB 3.4Å; L259-S263 PolarHBondContact O-N 2.86Å; L259-S263 PolarHBondContact O-OG 2.99Å; I260-S263 PolarHBondContact O-N 3.43Å; I260-S263 PolarHBondContact O-OG 3.03Å; D261-S263 VanDerWaalsContact C-N 3.34Å; D261-S263 PolarHBondContact O-N 3.05Å; S263-Q266 PolarHBondContact O-N 2.86Å; S263-L267 WeakPolarHBondContact O-CB 3.45Å; S263-L267 PolarHBondContact O-N 2.87Å
264	M	76.9	Confident	76.4	Confident	78 Å²	78	84.8 Å²	84.8	38%	0.384	42%	0.415	S	S	.	.	H	α-helix	trans	-66.5	-42.5	175.9	-71.9	-55.7	-56	0	0	111.3	I260 D261 Q266 L267 E268	I260-M264 HydrophobicContact CG2-CG 4.28Å; I260-M264 WeakPolarHBondContact O-CG 3.42Å; I260-M264 PolarHBondContact O-N 3.37Å; D261-M264 PolarHBondContact O-N 2.85Å; M264-Q266 VanDerWaalsContact C-N 3.34Å; M264-Q266 PolarHBondContact O-N 3.4Å; M264-L267 VanDerWaalsContact O-CB 3.29Å; M264-L267 WeakPolarHBondContact O-CB 3.39Å; M264-L267 PolarHBondContact O-N 3.3Å; M264-L267 HydrophobicContact SD-CD1 3.94Å; M264-E268 WeakPolarHBondContact O-CG 3.28Å; M264-E268 PolarHBondContact O-N 3.35Å
265	H	82.5	Confident	75	Confident	116 Å²	116	84.1 Å²	84.1	54%	0.537	41%	0.412	S	S	.	.	H	α-helix	trans	-64	-38.4	175.5	-173.6	63.1	0	0	0	112.4	D261 E268 T269	D261-H265 WeakPolarHBondContact O-CB 3.31Å; D261-H265 PolarHBondContact O-N 2.68Å; H265-E268 PolarHBondContact O-N 3.45Å; H265-T269 VanDerWaalsContact O-CB 3.31Å; H265-T269 WeakPolarHBondContact O-CB 3.31Å; H265-T269 PolarHBondContact O-N 2.95Å; H265-T269 PolarHBondContact O-OG1 3.37Å
266	Q	75.8	Confident	73.4	Confident	119 Å²	119	87.7 Å²	87.7	56%	0.556	43%	0.431	S	S	*	.	H	α-helix	trans	-64.8	-39.8	173	-74.2	176.4	24.4	0	0	112.1	N262 S263 M264 T269 Y270	N262-Q266 VanDerWaalsContact O-CG 3.31Å; N262-Q266 WeakPolarHBondContact O-CG 3.31Å; N262-Q266 PolarHBondContact O-N 3.3Å; S263-Q266 PolarHBondContact O-N 2.86Å; M264-Q266 VanDerWaalsContact C-N 3.34Å; M264-Q266 PolarHBondContact O-N 3.4Å; Q266-T269 PolarHBondContact O-N 3.38Å; Q266-Y270 VanDerWaalsContact O-CB 3.25Å; Q266-Y270 WeakPolarHBondContact O-CB 3.2Å; Q266-Y270 PolarHBondContact O-N 2.89Å
267	L	74.4	Confident	71.8	Confident	30 Å²	30	90.9 Å²	90.9	16%	0.157	45%	0.449	C	S	.	.	H	α-helix	trans	-61.2	-47.8	173	-91.2	153.4	0	0	0	111.6	L118 S263 M264 Y270 L271	L118-L267 HydrophobicContact CB-CD1 4.14Å; L118-L267 HydrophobicContact CB-CD2 4.21Å; L118-L267 HydrophobicContact CD1-CD1 4.33Å; L118-L267 HydrophobicContact CD1-CD2 3.44Å; L118-L267 VanDerWaalsContact CD1-CD2 3.44Å; L118-L267 HydrophobicContact CD1-CG 3.87Å; L118-L267 HydrophobicContact CG-CD2 4.41Å; S263-L267 WeakPolarHBondContact O-CB 3.45Å; S263-L267 PolarHBondContact O-N 2.87Å; M264-L267 VanDerWaalsContact O-CB 3.29Å; M264-L267 WeakPolarHBondContact O-CB 3.39Å; M264-L267 PolarHBondContact O-N 3.3Å; M264-L267 HydrophobicContact SD-CD1 3.94Å; L267-Y270 PolarHBondContact O-N 3.02Å; L267-L271 WeakPolarHBondContact O-CB 3.33Å; L267-L271 VanDerWaalsContact O-CG 3.25Å; L267-L271 WeakPolarHBondContact O-CG 3.43Å; L267-L271 PolarHBondContact O-N 3.29Å
268	E	74.8	Confident	69.8	Low	114 Å²	114	91.4 Å²	91.4	53%	0.533	45%	0.452	S	S	.	.	H	α-helix	trans	-61	-45.4	177	-74.1	172.1	-178.2	0	0	111.1	M264 H265 Y270 L271 H272	M264-E268 WeakPolarHBondContact O-CG 3.28Å; M264-E268 PolarHBondContact O-N 3.35Å; H265-E268 PolarHBondContact O-N 3.45Å; E268-Y270 PolarHBondContact O-N 2.95Å; E268-L271 PolarHBondContact O-N 3.15Å; E268-H272 VanDerWaalsContact O-CB 3.27Å; E268-H272 WeakPolarHBondContact O-CB 3.4Å; E268-H272 PolarHBondContact O-N 2.9Å
269	T	75.7	Confident	67.7	Low	55 Å²	55	95.7 Å²	95.7	34%	0.337	47%	0.469	S	S	.	.	H	α-helix	trans	-62	-42.9	175.8	-57.7	0	0	0	0	111.2	H265 Q266 H272 N273	H265-T269 VanDerWaalsContact O-CB 3.31Å; H265-T269 WeakPolarHBondContact O-CB 3.31Å; H265-T269 PolarHBondContact O-N 2.95Å; H265-T269 PolarHBondContact O-OG1 3.37Å; Q266-T269 PolarHBondContact O-N 3.38Å; T269-H272 PolarHBondContact O-N 3.4Å; T269-N273 WeakPolarHBondContact CG2-ND2 3.31Å; T269-N273 VanDerWaalsContact O-CB 3.28Å; T269-N273 WeakPolarHBondContact O-CB 3.5Å; T269-N273 PolarHBondContact O-N 3.46Å; T269-N273 PolarHBondContact O-ND2 2.88Å; T269-N273 VanDerWaalsContact O-ND2 3.11Å
270	Y	72.5	Confident	65.7	Low	86 Å²	86	99.5 Å²	99.5	34%	0.337	48%	0.478	S	S	.	.	H	α-helix	trans	-62.4	-45.3	175.9	177.6	-97.4	0	0	0	111.5	Q266 L267 E268 N273 H274	Q266-Y270 VanDerWaalsContact O-CB 3.25Å; Q266-Y270 WeakPolarHBondContact O-CB 3.2Å; Q266-Y270 PolarHBondContact O-N 2.89Å; L267-Y270 PolarHBondContact O-N 3.02Å; E268-Y270 PolarHBondContact O-N 2.95Å; Y270-N273 PolarHBondContact O-N 3Å; Y270-H274 AromaticContact CE2-CD2 3.41Å; Y270-H274 VanDerWaalsContact CE2-CD2 3.41Å; Y270-H274 WeakPolarHBondContact CE2-CD2 3.32Å; Y270-H274 AromaticContact CE2-NE2 3.83Å; Y270-H274 AromaticContact CZ-CD2 3.43Å; Y270-H274 VanDerWaalsContact CZ-CD2 3.43Å; Y270-H274 AromaticContact CZ-NE2 3.86Å; Y270-H274 WeakPolarHBondContact O-CB 3.4Å; Y270-H274 PolarHBondContact O-N 2.99Å
271	L	70.9	Confident	63.5	Low	86 Å²	86	103.9 Å²	103.9	45%	0.45	50%	0.497	S	S	.	.	H	α-helix	trans	-69.1	-33.7	178.3	-70	171.4	0	0	0	112.6	L267 E268 H274	L267-L271 WeakPolarHBondContact O-CB 3.33Å; L267-L271 VanDerWaalsContact O-CG 3.25Å; L267-L271 WeakPolarHBondContact O-CG 3.43Å; L267-L271 PolarHBondContact O-N 3.29Å; E268-L271 PolarHBondContact O-N 3.15Å; L271-H274 CarbonylContact O-C 3.57Å
272	H	71.5	Confident	61.3	Low	157 Å²	157	102.9 Å²	102.9	73%	0.727	50%	0.498	S	S	*	.	H	α-helix	trans	-71.1	-40.7	175.7	-162.1	77.7	0	0	0	111.5	E268 T269	E268-H272 VanDerWaalsContact O-CB 3.27Å; E268-H272 WeakPolarHBondContact O-CB 3.4Å; E268-H272 PolarHBondContact O-N 2.9Å; T269-H272 PolarHBondContact O-N 3.4Å
273	N	63.2	Low	59	Low	123 Å²	123	104 Å²	104	66%	0.658	51%	0.512	S	S	*	.	H	α-helix	trans	-72.9	-33.8	176.4	-69.6	-28.5	0	0	0	112.5	T269 Y270 H275	T269-N273 WeakPolarHBondContact CG2-ND2 3.31Å; T269-N273 VanDerWaalsContact O-CB 3.28Å; T269-N273 WeakPolarHBondContact O-CB 3.5Å; T269-N273 PolarHBondContact O-N 3.46Å; T269-N273 PolarHBondContact O-ND2 2.88Å; T269-N273 VanDerWaalsContact O-ND2 3.11Å; Y270-N273 PolarHBondContact O-N 3Å; N273-H275 PolarHBondContact O-N 3.25Å
274	H	57.1	Low	57	Low	122 Å²	122	110 Å²	110	57%	0.565	54%	0.537	S	S	*	.	S	Bend	trans	-83.1	66.8	167.6	-95.7	-79.4	0	0	0	110.8	Y270 L271 L276	Y270-H274 AromaticContact CE2-CD2 3.41Å; Y270-H274 VanDerWaalsContact CE2-CD2 3.41Å; Y270-H274 WeakPolarHBondContact CE2-CD2 3.32Å; Y270-H274 AromaticContact CE2-NE2 3.83Å; Y270-H274 AromaticContact CZ-CD2 3.43Å; Y270-H274 VanDerWaalsContact CZ-CD2 3.43Å; Y270-H274 AromaticContact CZ-NE2 3.86Å; Y270-H274 WeakPolarHBondContact O-CB 3.4Å; Y270-H274 PolarHBondContact O-N 2.99Å; L271-H274 CarbonylContact O-C 3.57Å; H274-L276 PolarHBondContact O-N 2.92Å; H274-L276 VanDerWaalsContact O-N 3.16Å
275	H	49.5	Very low	54.9	Low	92 Å²	92	114 Å²	114	43%	0.426	55%	0.553	S	S	.	*			trans	10.9	89.7	155.6	-143.5	-130.9	0	0	0	115.9	N273 N277 D278	N273-H275 PolarHBondContact O-N 3.25Å; H275-N277 PolarHBondContact CD2-ND2 3.48Å; H275-N277 VanDerWaalsContact CE1-CB 3.41Å; H275-N277 WeakPolarHBondContact CE1-CB 3.46Å; H275-N277 PolarHBondContact NE2-ND2 3.13Å; H275-N277 PolarHBondContact O-N 3.09Å; H275-D278 IonicContact CE1-OD1 3.7Å; H275-D278 IonicContact CG-OD1 3.54Å; H275-D278 IonicContact ND1-OD1 2.86Å; H275-D278 PolarHBondContact ND1-OD1 3.44Å; H275-D278 IonicContact ND1-OD2 4Å; H275-D278 PolarHBondContact O-N 3.13Å
276	L	45.1	Very low	52.4	Low	119 Å²	119	113 Å²	113	62%	0.623	56%	0.559	S	S	*	*	H	α-helix	trans	-52.7	-13.5	160	-94.4	155.5	0	0	0	113.1	H274	H274-L276 PolarHBondContact O-N 2.92Å; H274-L276 VanDerWaalsContact O-N 3.16Å
277	N	41.4	Very low	50.2	Low	95 Å²	95	114.7 Å²	114.7	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-83.9	-17.3	176.4	-44	-47.5	0	0	0	113.5	H275 H281	H275-N277 PolarHBondContact CD2-ND2 3.48Å; H275-N277 VanDerWaalsContact CE1-CB 3.41Å; H275-N277 WeakPolarHBondContact CE1-CB 3.46Å; H275-N277 PolarHBondContact NE2-ND2 3.13Å; H275-N277 PolarHBondContact O-N 3.09Å; N277-H281 PolarHBondContact O-N 3.17Å
278	D	42.3	Very low	48.1	Very low	92 Å²	92	121.3 Å²	121.3	49%	0.492	60%	0.6	S	S	.	*	H	α-helix	trans	-78.6	-27.1	174	-71.5	-3.1	0	0	0	111.6	H275 S282	H275-D278 IonicContact CE1-OD1 3.7Å; H275-D278 IonicContact CG-OD1 3.54Å; H275-D278 IonicContact ND1-OD1 2.86Å; H275-D278 PolarHBondContact ND1-OD1 3.44Å; H275-D278 IonicContact ND1-OD2 4Å; H275-D278 PolarHBondContact O-N 3.13Å; D278-S282 WeakPolarHBondContact O-CB 3.25Å; D278-S282 PolarHBondContact O-N 2.94Å; D278-S282 PolarHBondContact O-OG 3.28Å
279	W	39.1	Very low	46	Very low	190 Å²	190	121.4 Å²	121.4	72%	0.72	61%	0.614	S	S	*	*	H	α-helix	trans	-70.7	-35.3	-178.3	-170.5	59.7	0	0	0	112.6
280	Y	35.8	Very low	43.8	Very low	177 Å²	177	125.8 Å²	125.8	69%	0.694	64%	0.635	S	S	*	*	H	α-helix	trans	-86.2	-29.2	177.5	-106.5	-92.3	0	0	0	113.7
281	H	39.1	Very low	41.8	Very low	123 Å²	123	128.7 Å²	128.7	57%	0.569	66%	0.656	S	S	*	*	H	α-helix	trans	-92.6	-29.8	179.8	-81.3	-52.9	0	0	0	114.6	N277 S283 M284 K285	N277-H281 PolarHBondContact O-N 3.17Å; H281-S283 VanDerWaalsContact C-N 3.32Å; H281-S283 PolarHBondContact O-N 3.48Å; H281-M284 PolarHBondContact O-N 3.42Å; H281-K285 PolarHBondContact O-N 3.38Å
282	S	35.6	Very low	40	Very low	75 Å²	75	132.1 Å²	132.1	52%	0.524	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-20.2	179	-62.5	0	0	0	0	113.8	D278 M284	D278-S282 WeakPolarHBondContact O-CB 3.25Å; D278-S282 PolarHBondContact O-N 2.94Å; D278-S282 PolarHBondContact O-OG 3.28Å; S282-M284 VanDerWaalsContact C-N 3.27Å; S282-M284 PolarHBondContact O-N 3.44Å
283	S	35.9	Very low	38.2	Very low	98 Å²	98	131.9 Å²	131.9	69%	0.685	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-4.8	175.1	-158.9	0	0	0	0	113.5	H281	H281-S283 VanDerWaalsContact C-N 3.32Å; H281-S283 PolarHBondContact O-N 3.48Å
284	M	37.2	Very low	36.6	Very low	162 Å²	162	133.8 Å²	133.8	80%	0.798	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	-12.3	-176.4	-79.5	-73.8	147.2	0	0	115	H281 S282	H281-M284 PolarHBondContact O-N 3.42Å; S282-M284 VanDerWaalsContact C-N 3.27Å; S282-M284 PolarHBondContact O-N 3.44Å
285	K	33.3	Very low	35.6	Very low	163 Å²	163	136.7 Å²	136.7	71%	0.709	69%	0.69	S	S	*	*			trans	-151.6	95.7	-179.4	-69.8	-179.9	179.2	177.4	0	112.4	H281	H281-K285 PolarHBondContact O-N 3.38Å
286	S	30.8	Very low	34.7	Very low	96 Å²	96	139.7 Å²	139.7	67%	0.671	71%	0.709	S	S	*	*			trans	-172.6	60.7	150.8	51.7	0	0	0	0	112.8
287	I	29.2	Very low	34.4	Very low	153 Å²	153	142 Å²	142	79%	0.785	72%	0.719	S	S	*	*	S	Bend	trans	-86.2	92.4	139.6	-63.4	169.4	0	0	0	104.2
288	Q	30.4	Very low	34.4	Very low	169 Å²	169	144 Å²	144	79%	0.79	74%	0.735	S	S	*	*	S	Bend	trans	156.6	135.5	151.3	-91.6	167.2	-21.4	0	0	112.1
289	S	31.3	Very low	34.2	Very low	117 Å²	117	144.9 Å²	144.9	82%	0.818	75%	0.745	S	S	*	*			trans	73.1	115.7	153.5	30.1	0	0	0	0	119.9
290	N	28.9	Very low	34.1	Very low	147 Å²	147	141.5 Å²	141.5	79%	0.786	74%	0.741	S	S	*	*			trans	-53.8	142.6	164.7	-51.3	-39.6	0	0	0	112.5
291	D	30.4	Very low	34.2	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	74%	0.741	S	S	*	*				167.5	161.8	121.9	-83	-23.3	0	0	0	108.8
292	I	33.6	Very low	34.3	Very low	157 Å²	157	139.1 Å²	139.1	81%	0.805	74%	0.744	S	S	*	*			trans	113	86.9	162.8	-51.9	158.3	0	0	0	115.9
293	Q	34	Very low	34.4	Very low	152 Å²	152	143.5 Å²	143.5	71%	0.71	75%	0.753	S	S	*	*				41.7	117	125.9	-62.9	-174.7	-1.8	0	0	121.1
294	D	28.5	Very low	34.3	Very low	164 Å²	164	147.4 Å²	147.4	88%	0.877	76%	0.759	S	S	*	*			trans	-55.6	121.5	166.9	-66.2	-51	0	0	0	113.4
295	Y	35.7	Very low	33.9	Very low	182 Å²	182	145 Å²	145	71%	0.714	75%	0.753	S	S	*	*			trans	-117.9	120	159.3	-78.3	-82.2	0	0	0	110.4	M297	Y295-M297 PolarHBondContact O-N 3.04Å
296	N	31.7	Very low	33.9	Very low	156 Å²	156	147.2 Å²	147.2	83%	0.834	76%	0.763	S	S	*	*			trans	-52.7	118.5	177.6	-70.4	-38.9	0	0	0	113
297	M	38.2	Very low	33.9	Very low	166 Å²	166	149.3 Å²	149.3	82%	0.818	77%	0.766	S	S	*	*			trans	-124.4	110.5	168.8	-63.3	-62.3	142.8	0	0	111.1	Y295	Y295-M297 PolarHBondContact O-N 3.04Å
298	T	41.5	Very low	34	Very low	139 Å²	139	149.5 Å²	149.5	85%	0.853	77%	0.767	S	S	*	*			trans	-65.9	137.3	176.5	7.5	0	0	0	0	112.1
299	P	37.1	Very low	33.9	Very low	109 Å²	109	150.7 Å²	150.7	71%	0.708	77%	0.773	S	S	*	*			trans	-72.1	144.1	177.5	28.4	-32.7	0	0	0	112.4	N301	P299-N301 PolarHBondContact O-N 3.36Å
300	L	38.6	Very low	34	Very low	119 Å²	119	152.6 Å²	152.6	62%	0.623	77%	0.773	S	S	*	*			trans	-44	111.2	174.7	-84.3	142.4	0	0	0	112.8	L302	L300-L302 PolarHBondContact O-N 3.24Å
301	N	38	Very low	34	Very low	132 Å²	132	154.6 Å²	154.6	71%	0.706	78%	0.778	S	S	*	*			trans	-87.4	94.6	167.9	-104	-63.4	0	0	0	109.5	P299 K303	P299-N301 PolarHBondContact O-N 3.36Å; N301-K303 PolarHBondContact O-N 2.72Å
302	L	41	Very low	34.2	Very low	119 Å²	119	155.2 Å²	155.2	62%	0.623	78%	0.781	S	S	*	*			trans	-83.2	85.5	157.1	-81.3	113.2	0	0	0	108.5	L300 F304	L300-L302 PolarHBondContact O-N 3.24Å; L302-F304 HydrophobicContact CD2-CE2 4.4Å; L302-F304 PolarHBondContact O-N 3.27Å
303	K	36.9	Very low	33.9	Very low	166 Å²	166	155.1 Å²	155.1	72%	0.722	78%	0.781	S	S	*	*			trans	-83.4	101.5	167.6	-79.5	-176.1	177.8	179.1	0	109.1	N301 T305	N301-K303 PolarHBondContact O-N 2.72Å; K303-T305 PolarHBondContact O-N 3Å
304	F	33	Very low	33.9	Very low	181 Å²	181	156.4 Å²	156.4	79%	0.794	79%	0.787	S	S	*	*			trans	-72.2	103.2	158.7	-73.1	-83.9	0	0	0	108.2	L302 K306	L302-F304 HydrophobicContact CD2-CE2 4.4Å; L302-F304 PolarHBondContact O-N 3.27Å; F304-K306 PolarHBondContact O-N 3.46Å; F304-K306 VanDerWaalsContact O-N 3.1Å
305	T	30	Very low	33.9	Very low	112 Å²	112	154.6 Å²	154.6	69%	0.687	78%	0.777	S	S	*	*			trans	-69	103.3	169.7	43.9	0	0	0	0	109.1	K303 N307	K303-T305 PolarHBondContact O-N 3Å; T305-N307 PolarHBondContact O-N 3.31Å
306	K	34	Very low	33.8	Very low	208 Å²	208	152.5 Å²	152.5	90%	0.904	78%	0.778	S	S	*	*			trans	-87.8	82.3	172.9	-151.7	179.3	-170.2	-178.4	0	108.2	F304	F304-K306 PolarHBondContact O-N 3.46Å; F304-K306 VanDerWaalsContact O-N 3.1Å
307	N	29.1	Very low	33.8	Very low	141 Å²	141	151.4 Å²	151.4	75%	0.754	77%	0.773	S	S	*	*			trans	-105.8	93.4	174.7	-74.2	-3.7	0	0	0	109.7	T305	T305-N307 PolarHBondContact O-N 3.31Å
308	I	31.3	Very low	33.5	Very low	157 Å²	157	152.5 Å²	152.5	81%	0.805	77%	0.773	S	S	*	*			trans	-147.2	80	155.3	-52.2	179.3	0	0	0	106.8
309	E	28.9	Very low	33	Very low	194 Å²	194	150.7 Å²	150.7	91%	0.907	77%	0.766	S	S	*	*			trans	-113.9	114.4	150.8	-96.1	-177.8	170.5	0	0	106.4	E311	E309-E311 PolarHBondContact O-N 2.92Å
310	L	32.7	Very low	32.6	Very low	157 Å²	157	152.8 Å²	152.8	82%	0.822	77%	0.771	S	S	*	*			trans	-62.8	112.4	173	-83.7	140	0	0	0	108.5	N312	L310-N312 PolarHBondContact O-N 3.23Å
311	E	30.7	Very low	32.4	Very low	188 Å²	188	156.2 Å²	156.2	88%	0.879	78%	0.784	S	S	*	*			trans	-59	123.4	162.6	-87.7	-170.1	147.3	0	0	109.5	E309 L313	E309-E311 PolarHBondContact O-N 2.92Å; E311-L313 PolarHBondContact O-N 3.47Å
312	N	33.3	Very low	31.9	Very low	161 Å²	161	157.1 Å²	157.1	86%	0.861	79%	0.789	S	S	*	*			trans	-67.2	119.7	163.3	-80.8	-47.6	0	0	0	109.1	L310 H314	L310-N312 PolarHBondContact O-N 3.23Å; N312-H314 PolarHBondContact O-N 3.48Å
313	L	27.6	Very low	31.6	Very low	154 Å²	154	159.9 Å²	159.9	81%	0.806	80%	0.798	S	S	*	*			trans	-45	122.6	161.4	-76.9	146	0	0	0	111.4	E311	E311-L313 PolarHBondContact O-N 3.47Å
314	H	33.5	Very low	31.1	Very low	180 Å²	180	156.8 Å²	156.8	83%	0.833	80%	0.797	S	S	*	*			trans	-144.7	101.3	144.3	-110.5	73.2	0	0	0	110.5	N312	N312-H314 PolarHBondContact O-N 3.48Å
315	N	29.5	Very low	31	Very low	125 Å²	125	153.5 Å²	153.5	67%	0.668	79%	0.793	S	S	*	*			trans	12	121.6	142.5	-62.6	-23.6	0	0	0	117.7
316	N	32.8	Very low	30.9	Very low	138 Å²	138	155.9 Å²	155.9	74%	0.738	80%	0.796	S	S	*	*				175.2	121.7	99	-88.7	-40.4	0	0	0	112.7
317	N	32.5	Very low	30.8	Very low	134 Å²	134	153.4 Å²	153.4	72%	0.717	79%	0.787	S	S	*	*			trans	50.2	112.5	134.7	-63.9	-30.6	0	0	0	120.2
318	K	31.9	Very low	31	Very low	189 Å²	189	154.3 Å²	154.3	82%	0.822	79%	0.787	S	S	*	*				142.4	136.3	87.3	-113.8	177.7	179.8	179.4	0	113.9
319	S	31.5	Very low	30.9	Very low	100 Å²	100	156.3 Å²	156.3	70%	0.699	79%	0.79	S	S	*	*			trans	60.4	108.7	158.8	65.5	0	0	0	0	119
320	N	26.8	Very low	31	Very low	153 Å²	153	153 Å²	153	82%	0.818	78%	0.783	S	S	*	*				65	109.6	78.3	-74.7	-10	0	0	0	113.4
321	Q	35.4	Very low	30.7	Very low	192 Å²	192	151 Å²	151	90%	0.897	78%	0.783	S	S	*	*				-174.2	148.3	96.5	-92.7	-170	-0.4	0	0	111.9
322	N	27.6	Very low	30.9	Very low	151 Å²	151	148.5 Å²	148.5	81%	0.807	78%	0.78	S	S	*	*			trans	-88.5	163	-171.2	-62.3	-46.7	0	0	0	113.1
323	Q	34.2	Very low	30.7	Very low	177 Å²	177	145.3 Å²	145.3	83%	0.827	78%	0.776	S	S	*	*			trans	145.2	106.4	134.6	-82.3	175.1	-5.1	0	0	109.3
324	S	27.5	Very low	31.1	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	77%	0.774	S	S	*	*				50.5	124.5	88.9	67.1	0	0	0	0	111.8
325	T	30.8	Very low	30.9	Very low	113 Å²	113	142.5 Å²	142.5	69%	0.693	77%	0.771	S	S	*	*				-173.8	147.7	62.9	-44.5	0	0	0	0	109.7
326	E	27.5	Very low	31	Very low	161 Å²	161	142.5 Å²	142.5	75%	0.752	78%	0.775	S	S	*	*			trans	-3.1	148.8	151.4	-58.9	158.6	159.5	0	0	117.8
327	E	32.5	Very low	30.8	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	77%	0.774	S	S	*	*				175.4	150.6	63.6	-134.7	161.6	-148.4	0	0	111.4
328	Q	33	Very low	31	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.752	77%	0.774	S	S	*	*			trans	54	120.3	148.9	-78.7	173	10.4	0	0	122.2
329	F	27.7	Very low	31.1	Very low	198 Å²	198	137.7 Å²	137.7	87%	0.868	77%	0.769	S	S	*	*				107	145.3	61.4	-119.3	-84.5	0	0	0	112.9
330	V	32.1	Very low	31.2	Very low	126 Å²	126	139.8 Å²	139.8	76%	0.764	77%	0.768	S	S	*	*			trans	107.8	108.2	158.6	-167.3	0	0	0	0	118
331	S	25.7	Very low	31.6	Very low	115 Å²	115	141 Å²	141	80%	0.804	77%	0.766	S	S	*	*			trans	-74.1	152.5	167	-53.2	0	0	0	0	113.1
332	T	35.3	Very low	31.5	Very low	134 Å²	134	136.2 Å²	136.2	82%	0.822	75%	0.754	S	S	*	*			trans	-148.5	126.5	152.8	-62.5	0	0	0	0	109.2
333	A	29	Very low	32	Very low	94 Å²	94	135.9 Å²	135.9	78%	0.777	75%	0.75	S	S	*	*			trans	-109.4	135.3	175.7	0	0	0	0	0	109.8
334	V	35.4	Very low	32.1	Very low	125 Å²	125	134 Å²	134	76%	0.758	75%	0.746	S	S	*	*			trans	-156	100.6	161.8	-174	0	0	0	0	106.7
335	I	29.7	Very low	32.6	Very low	151 Å²	151	134.4 Å²	134.4	77%	0.774	75%	0.749	S	S	*	*				47.4	124.7	99.8	-46	178.5	0	0	0	115.2
336	V	32.5	Very low	32.9	Very low	125 Å²	125	138.4 Å²	138.4	76%	0.758	76%	0.757	S	S	*	*				152.9	110	127	172.8	0	0	0	0	112.2
337	S	29.1	Very low	32.9	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	76%	0.759	S	S	*	*			trans	15	159.2	139.7	-51.2	0	0	0	0	125.8
338	S	36.2	Very low	33.2	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	77%	0.765	S	S	*	*			trans	75.9	143.3	147.7	49.3	0	0	0	0	118.1
339	E	33.5	Very low	33.1	Very low	155 Å²	155	134.8 Å²	134.8	72%	0.724	77%	0.766	S	S	*	*			cis	-174.2	146.9	4.7	-111.3	178.1	151.9	0	0	109
340	Q	34.4	Very low	33.5	Very low	145 Å²	145	131.6 Å²	131.6	68%	0.678	76%	0.763	S	S	*	*			trans	57.8	148.4	136	-66.9	-175.8	19.8	0	0	126.2
341	K	34.6	Very low	33.3	Very low	178 Å²	178	131.1 Å²	131.1	77%	0.774	76%	0.761	S	S	*	*			trans	92	106.1	151.3	-81.2	167.7	-177.7	175.7	0	117.6
342	S	32.7	Very low	33.8	Very low	91 Å²	91	130.7 Å²	130.7	64%	0.636	76%	0.758	S	S	*	*				93.1	132.5	64.7	70	0	0	0	0	112.7
343	I	39.4	Very low	33.8	Very low	145 Å²	145	130.2 Å²	130.2	74%	0.744	76%	0.755	S	S	*	*			trans	155.4	109.3	131.4	-75.9	154.3	0	0	0	112.7
344	N	36.5	Very low	34.2	Very low	136 Å²	136	133.9 Å²	133.9	73%	0.727	76%	0.756	S	S	*	*				58.9	122.8	129.8	-61.8	-15.9	0	0	0	126
345	S	37.4	Very low	34.2	Very low	110 Å²	110	132.9 Å²	132.9	77%	0.769	75%	0.754	S	S	*	*				76.8	149.7	123.4	80.1	0	0	0	0	118.9
346	K	36.2	Very low	34.6	Very low	196 Å²	196	130.6 Å²	130.6	85%	0.852	75%	0.752	S	S	*	*			cis	-169.2	143.8	15.3	-149.1	159.8	179.2	173.3	0	108.1
347	C	28.7	Very low	34.6	Very low	119 Å²	119	130.7 Å²	130.7	80%	0.804	75%	0.748	S	S	*	*			trans	-88.2	166.5	163.7	-63.6	0	0	0	0	111
348	P	39.2	Very low	34.9	Very low	132 Å²	132	135.5 Å²	135.5	86%	0.857	75%	0.752	S	S	*	*				-142.8	159.8	125.5	33.4	-16	0	0	0	116
349	I	30.6	Very low	34.8	Very low	152 Å²	152	135.2 Å²	135.2	78%	0.779	75%	0.75	S	S	*	*			trans	-100.8	143.8	178.7	-66.3	163.3	0	0	0	109.5
350	T	35	Very low	34.7	Very low	130 Å²	130	134 Å²	134	80%	0.798	75%	0.754	S	S	*	*			trans	-158.9	105.3	154.2	43.3	0	0	0	0	108.7
351	T	28.4	Very low	34.6	Very low	117 Å²	117	138.6 Å²	138.6	72%	0.718	77%	0.765	S	S	*	*				53.2	117.3	83.5	60.7	0	0	0	0	117.9
352	S	36.3	Very low	34.6	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	77%	0.765	S	S	*	*			trans	152.6	114.6	132.8	57.7	0	0	0	0	111.8
353	T	35.9	Very low	34.9	Very low	123 Å²	123	140.3 Å²	140.3	76%	0.755	78%	0.775	S	S	*	*				66.1	125.3	112.7	58.8	0	0	0	0	113.9
354	E	37	Very low	34.6	Very low	171 Å²	171	139.2 Å²	139.2	80%	0.799	78%	0.777	S	S	*	*				-178.8	130.6	52.8	-112.6	158.6	-164.9	0	0	106.1
355	S	35.4	Very low	34.3	Very low	104 Å²	104	141.2 Å²	141.2	73%	0.727	79%	0.787	S	S	*	*				81	139.5	99.1	95.7	0	0	0	0	118.2
356	S	37.4	Very low	34.1	Very low	103 Å²	103	147 Å²	147	72%	0.72	79%	0.792	S	S	*	*			trans	100.8	115.9	161.6	77.7	0	0	0	0	119.7
357	N	32	Very low	33.7	Very low	128 Å²	128	147.9 Å²	147.9	68%	0.684	79%	0.792	S	S	*	*			trans	-53.4	170.7	166.8	-57.6	-56.9	0	0	0	110.6
358	Y	36.8	Very low	33.9	Very low	202 Å²	202	148.3 Å²	148.3	79%	0.792	79%	0.786	S	S	*	*				-166.7	149.5	55.2	-52.8	-91	0	0	0	111.3
359	S	32.6	Very low	33.6	Very low	97 Å²	97	148.5 Å²	148.5	68%	0.678	78%	0.78	S	S	*	*			trans	83.3	103.1	131.4	-149.7	0	0	0	0	121.5
360	T	32.1	Very low	33.6	Very low	129 Å²	129	147.7 Å²	147.7	79%	0.791	78%	0.777	S	S	*	*				72.6	120.5	125.5	63.5	0	0	0	0	121.2
361	R	33.2	Very low	33.5	Very low	241 Å²	241	148.9 Å²	148.9	91%	0.909	78%	0.779	S	S	*	*				127.1	90.7	115.7	-165	177.9	178.5	-159.1	0.4	113.4
362	S	33.8	Very low	33.7	Very low	113 Å²	113	153.1 Å²	153.1	79%	0.79	79%	0.787	S	S	*	*			trans	-156.6	96.7	152	50.2	0	0	0	0	112.1
363	K	38.3	Very low	33.5	Very low	192 Å²	192	155.2 Å²	155.2	84%	0.835	80%	0.796	S	S	*	*			trans	43.4	138	138	-61	179.6	-178.5	175.1	0	120.4
364	P	33.6	Very low	33.5	Very low	123 Å²	123	160.6 Å²	160.6	80%	0.799	80%	0.802	S	S	*	*			trans	-74.7	130.1	178.3	32.6	-32	0	0	0	110.6	R366	P364-R366 PolarHBondContact O-N 3.19Å; P364-R366 VanDerWaalsContact O-N 3.09Å
365	L	31.6	Very low	33.3	Very low	178 Å²	178	162.6 Å²	162.6	93%	0.932	80%	0.802	S	S	*	*			trans	-71.7	102.1	165.9	-84.5	162.2	0	0	0	108.5	Y367	L365-Y367 PolarHBondContact O-N 2.96Å
366	R	32.1	Very low	33.2	Very low	231 Å²	231	165.1 Å²	165.1	87%	0.872	81%	0.807	S	S	*	*			trans	-49.3	131.7	165.7	-92.7	-179.1	175.1	176.9	-1.9	110.2	P364 N368	P364-R366 PolarHBondContact O-N 3.19Å; P364-R366 VanDerWaalsContact O-N 3.09Å; R366-N368 PolarHBondContact O-N 3.39Å; R366-N368 VanDerWaalsContact O-N 3.08Å
367	Y	28.9	Very low	33	Very low	215 Å²	215	170 Å²	170	84%	0.843	81%	0.81	S	S	*	*			trans	-42	111.6	150.4	-107.7	-101.3	0	0	0	109.5	L365	L365-Y367 PolarHBondContact O-N 2.96Å
368	N	32.8	Very low	33.1	Very low	128 Å²	128	172 Å²	172	68%	0.684	82%	0.818	S	S	*	*			trans	-111.8	84.8	169	-157.9	3.4	0	0	0	107.5	R366 N370	R366-N368 PolarHBondContact O-N 3.39Å; R366-N368 VanDerWaalsContact O-N 3.08Å; N368-N370 PolarHBondContact O-N 3.45Å
369	N	31.6	Very low	32.8	Very low	136 Å²	136	170 Å²	170	73%	0.727	82%	0.816	S	S	*	*			trans	-67.1	88.6	160.2	-91.1	-13.4	0	0	0	107
370	N	31.3	Very low	33	Very low	135 Å²	135	172.9 Å²	172.9	72%	0.722	82%	0.818	S	S	*	*			trans	-171.4	78.3	161.4	-88.3	-27.2	0	0	0	108.9	N368	N368-N370 PolarHBondContact O-N 3.45Å
371	N	31.6	Very low	33	Very low	155 Å²	155	176.4 Å²	176.4	83%	0.829	82%	0.823	S	S	*	*			trans	-156.5	82.2	168.1	-86.7	-32.5	0	0	0	109.6
372	K	34.3	Very low	32.9	Very low	205 Å²	205	171.6 Å²	171.6	89%	0.891	82%	0.816	S	S	*	*			trans	175.8	57.9	144.1	-94.9	165	-174.1	178.1	0	111.2
373	T	32.4	Very low	32.8	Very low	151 Å²	151	171.2 Å²	171.2	93%	0.926	81%	0.813	S	S	*	*			trans	-91.1	76.8	144.2	32	0	0	0	0	108.3
374	R	34.5	Very low	32.6	Very low	235 Å²	235	169.6 Å²	169.6	89%	0.887	81%	0.808	S	S	*	*			trans	-102.4	97.4	150.1	-116.1	-178.5	-176.7	-169.3	1.3	103.3
375	R	32.5	Very low	32.5	Very low	213 Å²	213	170.8 Å²	170.8	80%	0.804	81%	0.807	S	S	*	*				30.5	105.7	87.1	-98.9	-178.4	168.6	179.4	-2.7	108.9
376	L	34.6	Very low	32.5	Very low	158 Å²	158	172.6 Å²	172.6	83%	0.827	81%	0.808	S	S	*	*				-152.3	151.9	80	-82.2	155.7	0	0	0	112.8
377	R	31.8	Very low	32.6	Very low	206 Å²	206	167 Å²	167	78%	0.777	80%	0.799	S	S	*	*			trans	-58.3	132.5	-175.4	-55.3	161.1	-173.7	137.9	-2.5	112.5
378	I	34.8	Very low	32.7	Very low	169 Å²	169	163.1 Å²	163.1	87%	0.867	79%	0.793	S	S	*	*			trans	-142.8	99.7	132.1	-58.3	-173.5	0	0	0	106.7
379	H	31.6	Very low	32.7	Very low	161 Å²	161	169 Å²	169	75%	0.745	81%	0.805	S	S	*	*			trans	-85.7	148.2	167.1	-146.6	-102.6	0	0	0	106.9
380	Q	35.6	Very low	33	Very low	156 Å²	156	170 Å²	170	73%	0.729	81%	0.811	S	S	*	*			trans	67.4	101.8	167.4	-68.4	162.2	-48	0	0	117.2
381	F	31.8	Very low	33.3	Very low	203 Å²	203	171.3 Å²	171.3	89%	0.89	81%	0.813	S	S	*	*	S	Bend	trans	-171.7	137.7	131.4	-115.5	-86.6	0	0	0	109.2
382	N	31.7	Very low	33.4	Very low	141 Å²	141	172.1 Å²	172.1	75%	0.754	82%	0.815	S	S	*	*	S	Bend	trans	86.8	31.1	-179.8	-61.8	-11.2	0	0	0	119.2
383	S	31.4	Very low	33.5	Very low	104 Å²	104	172.5 Å²	172.5	73%	0.727	82%	0.817	S	S	*	*	S	Bend	trans	-108.1	63.4	145.5	57.8	0	0	0	0	109.5
384	Q	33.9	Very low	33.8	Very low	158 Å²	158	174.4 Å²	174.4	74%	0.738	81%	0.812	S	S	*	*			trans	-156.4	20.3	173.7	-145.7	75.8	53.9	0	0	115.3
385	L	31.7	Very low	33.9	Very low	148 Å²	148	169.9 Å²	169.9	78%	0.775	80%	0.804	S	S	*	*	S	Bend	trans	-131.3	78.2	172.9	-68.4	174.9	0	0	0	108.3
386	F	32.3	Very low	33.9	Very low	217 Å²	217	166.4 Å²	166.4	95%	0.952	80%	0.802	S	S	*	*			trans	164.2	63.6	155.6	-87.7	-66.2	0	0	0	107.3
387	V	32.9	Very low	34	Very low	113 Å²	113	169.6 Å²	169.6	69%	0.685	80%	0.803	S	S	*	*	S	Bend	trans	-123.6	121.8	161	178.7	0	0	0	0	106.2
388	D	30.7	Very low	34.2	Very low	133 Å²	133	167.9 Å²	167.9	71%	0.711	81%	0.808	S	S	*	*			trans	56.1	88.7	160.9	-61.3	-23.3	0	0	0	119.5
389	R	33.3	Very low	33.9	Very low	251 Å²	251	165.3 Å²	165.3	95%	0.947	81%	0.805	S	S	*	*	S	Bend	trans	-100	12.2	156.1	-134	-179	-173.3	-171.8	2	114.1
390	N	37.6	Very low	34.3	Very low	158 Å²	158	163.4 Å²	163.4	85%	0.845	81%	0.807	S	S	*	*	S	Bend	trans	-115.1	16	-173.5	-79.8	-5.3	0	0	0	116
391	Q	38.1	Very low	34.2	Very low	163 Å²	163	161.3 Å²	161.3	76%	0.762	81%	0.81	S	S	*	*	S	Bend	trans	-139.9	96.5	167.9	-64.8	-151.9	70.8	0	0	109.9
392	I	33.1	Very low	34.1	Very low	171 Å²	171	156.8 Å²	156.8	88%	0.877	80%	0.802	S	S	*	*			trans	173.5	86.4	150.6	-80.9	144	0	0	0	105.9
393	K	37.4	Very low	34.2	Very low	214 Å²	214	158.1 Å²	158.1	93%	0.93	81%	0.809	S	S	*	*			trans	-167.7	59.8	149.5	-104.7	176	-173	-177	0	107.5
394	K	38.5	Very low	34.3	Very low	190 Å²	190	162.4 Å²	162.4	83%	0.826	82%	0.815	S	S	*	*			trans	-84.4	142.5	156.1	-132.4	173.9	-171.8	176.5	0	105.7
395	I	35.9	Very low	34.3	Very low	141 Å²	141	166.6 Å²	166.6	72%	0.723	82%	0.824	S	S	*	*			trans	84.9	88.8	162.5	-47.5	150.3	0	0	0	113.8
396	N	33.8	Very low	34.4	Very low	140 Å²	140	168 Å²	168	75%	0.749	83%	0.826	S	S	*	*				171.4	136.1	111.5	-90.2	-36.1	0	0	0	113.2
397	R	35.5	Very low	34.6	Very low	224 Å²	224	164.3 Å²	164.3	85%	0.845	82%	0.816	S	S	*	*			trans	83.1	86.7	163.4	-60	170.8	-173.9	-175.1	1.3	114.6
398	L	35.9	Very low	34.7	Very low	171 Å²	171	164.7 Å²	164.7	90%	0.895	81%	0.814	S	S	*	*				61.6	98.3	86	-66.2	167.4	0	0	0	111.9
399	S	29.5	Very low	34.9	Very low	114 Å²	114	164.9 Å²	164.9	80%	0.797	82%	0.815	S	S	*	*			trans	-46.5	168.9	148.8	-47.2	0	0	0	0	111.1
400	P	39.6	Very low	35.1	Very low	121 Å²	121	160 Å²	160	79%	0.786	81%	0.808	S	S	*	*			cis	-152.1	179.9	30	39.5	-16.2	0	0	0	117.9
401	S	34.4	Very low	35.3	Very low	113 Å²	113	159.5 Å²	159.5	79%	0.79	81%	0.81	S	S	*	*			trans	102.6	117.6	138.1	-156	0	0	0	0	118.3
402	C	28.2	Very low	35.4	Very low	107 Å²	107	160.2 Å²	160.2	72%	0.723	81%	0.813	S	S	*	*			trans	-54	153.6	168.9	-55.8	0	0	0	0	113.7
403	N	35.3	Very low	35.6	Very low	169 Å²	169	160.4 Å²	160.4	90%	0.904	81%	0.811	S	S	*	*				-158.9	131.4	122.7	-92.8	-31.8	0	0	0	111.8
404	K	32.6	Very low	35.7	Very low	195 Å²	195	154.9 Å²	154.9	85%	0.848	80%	0.796	S	S	*	*			trans	-74	153	175.2	-72.7	172.2	172.1	176.1	0	111.7
405	R	33.7	Very low	35.4	Very low	245 Å²	245	153.7 Å²	153.7	93%	0.925	79%	0.794	S	S	*	*			trans	166	95.2	146.9	-90.9	168.5	-146.1	-163.2	5.9	105.2
406	Q	34.7	Very low	35.5	Very low	178 Å²	178	154.8 Å²	154.8	83%	0.832	80%	0.801	S	S	*	*				62.5	130.5	67.8	-134.5	-176.8	38.7	0	0	114.8
407	L	36.1	Very low	35.7	Very low	139 Å²	139	157.4 Å²	157.4	73%	0.728	81%	0.806	S	S	*	*			trans	85.2	133.5	169.7	-56.5	146.5	0	0	0	114.6
408	N	34.4	Very low	36	Very low	122 Å²	122	154.2 Å²	154.2	65%	0.652	80%	0.804	S	S	*	*			cis	-165.1	129.8	2.5	-92.3	-15.6	0	0	0	105.5
409	D	35.6	Very low	36.4	Very low	137 Å²	137	151.4 Å²	151.4	73%	0.733	80%	0.796	S	S	*	*				75.4	136.2	98.8	-74.6	-26	0	0	0	116.9
410	D	36.4	Very low	36.8	Very low	149 Å²	149	153.6 Å²	153.6	80%	0.797	79%	0.793	S	S	*	*			trans	85.3	109.5	160	-51.9	-32.6	0	0	0	119.9
411	V	42.6	Very low	36.8	Very low	146 Å²	146	156.3 Å²	156.3	89%	0.885	80%	0.8	S	S	*	*				-177.6	132.6	119.1	160.8	0	0	0	0	110.3
412	E	41	Very low	36.9	Very low	179 Å²	179	156.2 Å²	156.2	84%	0.836	79%	0.791	S	S	*	*			trans	-55	158	179	-56.3	172.2	134.6	0	0	113.6
413	E	37.4	Very low	37.7	Very low	175 Å²	175	160.9 Å²	160.9	82%	0.818	80%	0.802	S	S	*	*				167	-174.8	65.7	-150	-162.5	144.5	0	0	108.1
414	P	38.1	Very low	38.1	Very low	97 Å²	97	156.7 Å²	156.7	63%	0.63	79%	0.786	S	S	*	*				-115.7	156.8	-95	39.4	-24.3	0	0	0	118.1
415	Q	33.7	Very low	38.4	Very low	165 Å²	165	155.3 Å²	155.3	77%	0.771	79%	0.787	S	S	*	*			trans	25.1	117.1	138.9	-54.2	-173.2	-1	0	0	121.9
416	N	37.2	Very low	38.8	Very low	165 Å²	165	148.5 Å²	148.5	88%	0.882	77%	0.769	S	S	*	*			trans	-120.2	112.1	148	-94.5	-33.1	0	0	0	109.8
417	K	37.4	Very low	39.4	Very low	195 Å²	195	144.4 Å²	144.4	85%	0.848	75%	0.752	S	S	*	*			trans	-73.8	123.7	175.4	-78	176.3	176.6	179.9	0	110.6
418	I	42	Very low	39.7	Very low	156 Å²	156	146.7 Å²	146.7	80%	0.8	75%	0.751	S	S	*	*			trans	-104.8	132	164.6	-59.9	172.8	0	0	0	107.7
419	P	44	Very low	40.4	Very low	113 Å²	113	146.4 Å²	146.4	73%	0.734	75%	0.748	S	S	*	*			trans	-70.8	131.3	176.2	-13.2	28.3	0	0	0	112.1	L421	P419-L421 PolarHBondContact O-N 2.86Å
420	H	38	Very low	40.5	Very low	160 Å²	160	149.4 Å²	149.4	74%	0.741	75%	0.751	S	S	*	*			trans	-58.3	105.8	175.9	-177.5	-101.9	0	0	0	112.7	D422	H420-D422 WeakPolarHBondContact CE1-CB 3.07Å; H420-D422 IonicContact CE1-OD2 2.65Å; H420-D422 WeakPolarHBondContact ND1-CB 3.14Å; H420-D422 IonicContact NE2-OD2 3.11Å; H420-D422 PolarHBondContact O-N 3.42Å
421	L	39.7	Very low	40.9	Very low	177 Å²	177	149.6 Å²	149.6	93%	0.927	75%	0.747	S	S	*	*			trans	-82.5	93.6	159.7	-88.6	114.1	0	0	0	108.1	P419	P419-L421 PolarHBondContact O-N 2.86Å
422	D	38	Very low	40.6	Very low	111 Å²	111	149.2 Å²	149.2	59%	0.594	74%	0.74	S	S	*	*			trans	-137.1	72.1	169.2	-140.8	4.9	0	0	0	108.2	H420 S424	H420-D422 WeakPolarHBondContact CE1-CB 3.07Å; H420-D422 IonicContact CE1-OD2 2.65Å; H420-D422 WeakPolarHBondContact ND1-CB 3.14Å; H420-D422 IonicContact NE2-OD2 3.11Å; H420-D422 PolarHBondContact O-N 3.42Å; D422-S424 VanDerWaalsContact C-N 3.29Å
423	E	44.7	Very low	40.4	Very low	205 Å²	205	147.5 Å²	147.5	96%	0.958	74%	0.737	S	S	*	*			trans	-104.1	53.1	161.9	-143.2	174.6	-160.9	0	0	107.5	L425	E423-L425 PolarHBondContact O-N 2.77Å
424	S	43.3	Very low	40.6	Very low	81 Å²	81	147.5 Å²	147.5	57%	0.566	74%	0.736	S	S	*	*			trans	-76.5	107.7	174	169.6	0	0	0	0	109.5	D422 D426	D422-S424 VanDerWaalsContact C-N 3.29Å; S424-D426 PolarHBondContact O-N 2.97Å
425	L	39.5	Very low	40.5	Very low	167 Å²	167	151.6 Å²	151.6	87%	0.874	74%	0.744	S	S	*	*			trans	33	64.3	145.6	-73.4	163.7	0	0	0	116.4	E423	E423-L425 PolarHBondContact O-N 2.77Å
426	D	41.3	Very low	41	Very low	101 Å²	101	151.1 Å²	151.1	54%	0.54	75%	0.747	S	S	.	*			trans	-126.3	89.2	167.9	-152.1	-5.2	0	0	0	110.8	S424 R428	S424-D426 PolarHBondContact O-N 2.97Å; D426-R428 PolarHBondContact O-N 3.26Å; D426-R428 VanDerWaalsContact O-N 3.13Å; D426-R428 WeakPolarHBondContact OD1-CG 3.28Å; D426-R428 IonicContact OD1-NE 3.63Å; D426-R428 PolarHBondContact OD1-NE 2.92Å; D426-R428 VanDerWaalsContact OD1-NE 3.11Å; D426-R428 IonicContact OD2-CZ 3.58Å; D426-R428 IonicContact OD2-NE 2.69Å; D426-R428 PolarHBondContact OD2-NE 3.35Å; D426-R428 IonicContact OD2-NH2 3.17Å; D426-R428 PolarHBondContact OD2-NH2 3.48Å
427	L	47.6	Very low	40.8	Very low	93 Å²	93	150 Å²	150	49%	0.487	74%	0.741	S	S	.	*			trans	-85.1	58.8	173.2	-76	166.9	0	0	0	110	I429 T511	L427-I429 PolarHBondContact O-N 3.37Å; L427-T511 HydrophobicContact CD1-CG2 3.59Å
428	R	42.2	Very low	40.9	Very low	186 Å²	186	147.7 Å²	147.7	70%	0.702	74%	0.738	S	S	*	*			trans	-85.8	106.3	165.1	-79.6	-175.1	-78.1	174	0.5	108.8	D426 Y430	D426-R428 PolarHBondContact O-N 3.26Å; D426-R428 VanDerWaalsContact O-N 3.13Å; D426-R428 WeakPolarHBondContact OD1-CG 3.28Å; D426-R428 IonicContact OD1-NE 3.63Å; D426-R428 PolarHBondContact OD1-NE 2.92Å; D426-R428 VanDerWaalsContact OD1-NE 3.11Å; D426-R428 IonicContact OD2-CZ 3.58Å; D426-R428 IonicContact OD2-NE 2.69Å; D426-R428 PolarHBondContact OD2-NE 3.35Å; D426-R428 IonicContact OD2-NH2 3.17Å; D426-R428 PolarHBondContact OD2-NH2 3.48Å; R428-Y430 PolarHBondContact O-N 3.35Å; R428-Y430 VanDerWaalsContact O-N 3.09Å
429	I	48.5	Very low	40.5	Very low	116 Å²	116	146.7 Å²	146.7	60%	0.595	73%	0.734	S	S	*	*			trans	-65.2	103.5	169.8	-60.2	172	0	0	0	107.1	L427 Q431	L427-I429 PolarHBondContact O-N 3.37Å; I429-Q431 HydrophobicContact CG2-CG 4.12Å; I429-Q431 PolarHBondContact O-N 2.9Å
430	Y	38.2	Very low	40.2	Very low	200 Å²	200	148.5 Å²	148.5	78%	0.784	74%	0.738	S	S	*	*			trans	-72.3	98.9	159.1	-94	-92.1	0	0	0	107.5	R428 N432	R428-Y430 PolarHBondContact O-N 3.35Å; R428-Y430 VanDerWaalsContact O-N 3.09Å; Y430-N432 PolarHBondContact O-N 3.02Å
431	Q	43.6	Very low	39.8	Very low	153 Å²	153	150 Å²	150	72%	0.715	74%	0.742	S	S	*	*			trans	-72.6	105.4	156.6	-82.6	175.8	-18.8	0	0	106.6	I429 D433	I429-Q431 HydrophobicContact CG2-CG 4.12Å; I429-Q431 PolarHBondContact O-N 2.9Å; Q431-D433 VanDerWaalsContact C-N 3.31Å; Q431-D433 PolarHBondContact O-N 2.84Å; Q431-D433 VanDerWaalsContact O-N 3.14Å
432	N	38	Very low	39.5	Very low	138 Å²	138	147 Å²	147	74%	0.738	73%	0.731	S	S	*	*			trans	-77.2	89.3	164.5	-76.8	-21.4	0	0	0	107.6	Y430 H434	Y430-N432 PolarHBondContact O-N 3.02Å; N432-H434 VanDerWaalsContact C-N 3.34Å; N432-H434 PolarHBondContact O-N 3.27Å; N432-H434 VanDerWaalsContact O-N 3.13Å
433	D	36.5	Very low	39.1	Very low	144 Å²	144	150.5 Å²	150.5	77%	0.77	74%	0.744	S	S	*	*			trans	-72.8	91.6	161.5	-75.1	-28.1	0	0	0	108	Q431 K435	Q431-D433 VanDerWaalsContact C-N 3.31Å; Q431-D433 PolarHBondContact O-N 2.84Å; Q431-D433 VanDerWaalsContact O-N 3.14Å; D433-K435 PolarHBondContact O-N 2.92Å
434	H	41.7	Very low	38.7	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.806	74%	0.735	S	S	*	*			trans	-83	107.9	163.9	-124.3	-69.4	0	0	0	108.4	N432 D436	N432-H434 VanDerWaalsContact C-N 3.34Å; N432-H434 PolarHBondContact O-N 3.27Å; N432-H434 VanDerWaalsContact O-N 3.13Å; H434-D436 PolarHBondContact O-N 2.72Å
435	K	35.8	Very low	38.2	Very low	184 Å²	184	152.4 Å²	152.4	80%	0.8	75%	0.747	S	S	*	*			trans	-54.7	119.2	167.1	-72.5	171.9	173.3	176	0	109.6	D433	D433-K435 PolarHBondContact O-N 2.92Å
436	D	43.4	Very low	38.2	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	74%	0.742	S	S	*	*			trans	-128	114.1	149.7	-80	-38.9	0	0	0	108.6	H434	H434-D436 PolarHBondContact O-N 2.72Å
437	N	34.3	Very low	37.8	Very low	141 Å²	141	151.5 Å²	151.5	75%	0.754	75%	0.749	S	S	*	*			trans	-63.5	134.1	173.8	-71	-45.4	0	0	0	109.8
438	N	38.3	Very low	37.4	Very low	147 Å²	147	154.1 Å²	154.1	79%	0.786	76%	0.763	S	S	*	*			trans	-173.5	102.7	130.1	-89.9	-32.8	0	0	0	111.2
439	N	33.7	Very low	37.2	Very low	134 Å²	134	151.5 Å²	151.5	72%	0.717	76%	0.763	S	S	*	*			trans	29.5	111.7	130.3	-57.4	-21.8	0	0	0	117.9
440	N	37	Very low	36.6	Very low	151 Å²	151	152.3 Å²	152.3	81%	0.807	77%	0.769	S	S	*	*				154.9	94.1	125.7	-72.6	-22.3	0	0	0	108.2
441	K	31.6	Very low	36.7	Very low	192 Å²	192	151.6 Å²	151.6	84%	0.835	77%	0.772	S	S	*	*				65.8	121.5	99.8	-103.4	-179.3	-178.3	175.1	0	114
442	T	32.1	Very low	36.4	Very low	113 Å²	113	149.6 Å²	149.6	69%	0.693	78%	0.775	S	S	*	*			trans	100.8	100.3	146.1	-15.7	0	0	0	0	116.4
443	E	30.2	Very low	36.6	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	77%	0.774	S	S	*	*			trans	-27.7	131.5	142.9	-57.9	174.9	154.1	0	0	112.4
444	Q	35.4	Very low	36.6	Very low	166 Å²	166	150.2 Å²	150.2	78%	0.776	78%	0.78	S	S	*	*			trans	-161.9	93.9	153.8	-110.4	162.9	89.8	0	0	110.1
445	I	33.5	Very low	36.2	Very low	160 Å²	160	146.8 Å²	146.8	82%	0.821	77%	0.774	S	S	*	*			trans	-53	133.3	139.6	-63.5	162.5	0	0	0	106.7
446	I	39.3	Very low	36.4	Very low	150 Å²	150	142.8 Å²	142.8	77%	0.769	77%	0.769	S	S	*	*			trans	175.1	133.6	143.2	-85	147.1	0	0	0	109.6
447	S	33.1	Very low	36.5	Very low	98 Å²	98	141.8 Å²	141.8	69%	0.685	76%	0.76	S	S	*	*			trans	-58.3	-177.8	172.2	-48.7	0	0	0	0	115.3
448	L	38.1	Very low	37	Very low	148 Å²	148	142 Å²	142	78%	0.775	77%	0.766	S	S	*	*			trans	90.2	136	174.7	-80.6	58.5	0	0	0	114
449	D	38.5	Very low	37.3	Very low	131 Å²	131	145 Å²	145	70%	0.701	77%	0.766	S	S	*	*			cis	-162.8	160.4	6.8	-118.4	-25.4	0	0	0	111.3
450	N	37	Very low	37.7	Very low	133 Å²	133	144.6 Å²	144.6	71%	0.711	76%	0.764	S	S	*	*			trans	-60.4	143.4	168.4	-62.9	-60.6	0	0	0	111.3
451	H	39.2	Very low	37.9	Very low	185 Å²	185	144.1 Å²	144.1	86%	0.856	75%	0.754	S	S	*	*				170.7	130.7	127.4	-89.3	-61.2	0	0	0	111
452	S	37.6	Very low	38.3	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	75%	0.754	S	S	*	*			trans	66.1	109.9	151.5	-158.7	0	0	0	0	116.2
453	S	42	Very low	38.9	Very low	102 Å²	102	144.1 Å²	144.1	71%	0.713	75%	0.75	S	S	*	*				-179.4	140.1	60.5	38.5	0	0	0	0	109.5
454	H	36.2	Very low	39.6	Very low	194 Å²	194	141 Å²	141	90%	0.898	74%	0.738	S	S	*	*			trans	-44.3	127.6	166	-150.6	-99.4	0	0	0	111.9
455	C	33.5	Very low	40.3	Very low	102 Å²	102	139.4 Å²	139.4	69%	0.689	73%	0.733	S	S	*	*	S	Bend	trans	156.9	121	144.5	-169.5	0	0	0	0	111.4
456	S	39.7	Very low	40.8	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	73%	0.73	S	S	*	*			trans	78.4	24.6	158.3	-53.5	0	0	0	0	122.4
457	Q	45.3	Very low	40.9	Very low	134 Å²	134	135.2 Å²	135.2	63%	0.626	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	10.4	-176.5	-73.7	-178.9	13.6	0	0	117.8
458	T	46.3	Very low	42.1	Very low	145 Å²	145	136.5 Å²	136.5	89%	0.89	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-7	-175.9	54	0	0	0	0	115.1
459	R	43.3	Very low	43.1	Very low	211 Å²	211	135.4 Å²	135.4	80%	0.796	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-15.6	-178.5	-146.4	174	-170.3	-161	1.8	115.4
460	L	42.4	Very low	45.2	Very low	125 Å²	125	135.3 Å²	135.3	65%	0.654	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-8.8	-177.9	-61.8	178.7	0	0	0	114.1	R462 S463	L460-R462 VanDerWaalsContact C-N 3.3Å; L460-R462 PolarHBondContact O-N 2.95Å; L460-S463 PolarHBondContact O-OG 2.78Å
461	K	41.7	Very low	47.6	Very low	142 Å²	142	131.6 Å²	131.6	62%	0.617	69%	0.691	S	S	*	*	H	α-helix	trans	-75.4	-13.4	175.1	-96.1	176.5	173.8	172	0	114.5	I465	K461-I465 VanDerWaalsContact O-CD1 3.28Å; K461-I465 WeakPolarHBondContact O-CD1 3.46Å; K461-I465 WeakPolarHBondContact O-CG1 3.3Å
462	R	40.3	Very low	49.9	Very low	217 Å²	217	126.5 Å²	126.5	82%	0.819	67%	0.673	S	S	*	*	H	α-helix	trans	-86.3	-22.1	-178.8	-170.9	168	-75.8	-144	-1.1	113.6	L460	L460-R462 VanDerWaalsContact C-N 3.3Å; L460-R462 PolarHBondContact O-N 2.95Å
463	S	43.2	Very low	52.5	Low	87 Å²	87	126.5 Å²	126.5	61%	0.608	67%	0.668	S	S	*	*	H	α-helix	trans	-85.5	-19.3	178.8	58.9	0	0	0	0	113.9	L460	L460-S463 PolarHBondContact O-OG 2.78Å
464	I	45.7	Very low	55	Low	120 Å²	120	122.9 Å²	122.9	62%	0.615	64%	0.641	S	S	*	*	H	α-helix	trans	-86.7	-20.1	-178.1	-58	173.7	0	0	0	112.1	N466 S467	I464-N466 VanDerWaalsContact C-N 3.26Å; I464-N466 PolarHBondContact O-N 2.91Å; I464-S467 PolarHBondContact O-N 3.28Å; I464-S467 PolarHBondContact O-OG 3.44Å
465	I	49.9	Very low	57.8	Low	133 Å²	133	116.3 Å²	116.3	68%	0.682	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-12.5	179.5	-63.3	169.1	0	0	0	112.6	K461 S467	K461-I465 VanDerWaalsContact O-CD1 3.28Å; K461-I465 WeakPolarHBondContact O-CD1 3.46Å; K461-I465 WeakPolarHBondContact O-CG1 3.3Å; I465-S467 PolarHBondContact O-N 3.36Å
466	N	44.3	Very low	60.8	Low	140 Å²	140	114.9 Å²	114.9	75%	0.749	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	7.1	173.2	-94.3	29.2	0	0	0	114.2	I464 Q468	I464-N466 VanDerWaalsContact C-N 3.26Å; I464-N466 PolarHBondContact O-N 2.91Å; N466-Q468 PolarHBondContact O-N 2.93Å
467	S	41.4	Very low	63.4	Low	83 Å²	83	113.3 Å²	113.3	58%	0.58	61%	0.605	S	S	*	*	S	Bend	trans	-69.7	85.7	161.1	51.5	0	0	0	0	108.3	I464 I465 T469	I464-S467 PolarHBondContact O-N 3.28Å; I464-S467 PolarHBondContact O-OG 3.44Å; I465-S467 PolarHBondContact O-N 3.36Å; S467-T469 PolarHBondContact O-N 3.02Å
468	Q	57.6	Low	65.9	Low	125 Å²	125	107.6 Å²	107.6	58%	0.584	58%	0.578	S	S	*	*			trans	-47.9	99.1	179	-72.1	171.7	-15.6	0	0	110.2	N466 K470	N466-Q468 PolarHBondContact O-N 2.93Å; Q468-K470 PolarHBondContact O-N 3.17Å
469	T	60.5	Low	68.3	Low	124 Å²	124	103.8 Å²	103.8	76%	0.761	55%	0.552	S	S	*	*			trans	-68.3	89.5	164.8	45.8	0	0	0	0	106.3	S467 T471	S467-T469 PolarHBondContact O-N 3.02Å; T469-T471 PolarHBondContact O-N 3.09Å
470	K	81.7	Confident	70.9	Confident	129 Å²	129	101.2 Å²	101.2	56%	0.561	55%	0.547	S	S	*	.			trans	-53.9	118.3	178.2	-68.2	-177.1	177.6	175.8	0	108.3	Q468 E503 C505	Q468-K470 PolarHBondContact O-N 3.17Å; K470-E503 CarbonylContact C-O 3.53Å; K470-E503 WeakPolarHBondContact CA-O 3.24Å; K470-C505 HydrophobicContact CB-CB 3.87Å
471	T	87.5	Confident	73.4	Confident	55 Å²	55	98.1 Å²	98.1	34%	0.337	53%	0.528	S	S	.	.	B	Isolated β-bridge	trans	-81.3	129	-177.2	63.3	0	0	0	0	109.4	T469 E503 V504 C505	T469-T471 PolarHBondContact O-N 3.09Å; T471-E503 PolarHBondContact N-O 3.03Å; T471-E503 PolarHBondContact OG1-O 3.27Å; T471-E503 VanDerWaalsContact OG1-O 3.11Å; T471-V504 WeakPolarHBondContact O-CA 3.24Å; T471-C505 PolarHBondContact O-N 3.2Å
472	T	87.7	Confident	76	Confident	79 Å²	79	91.3 Å²	91.3	49%	0.485	50%	0.499	S	S	.	.	S	Bend	trans	-82.5	-20.5	174.1	53	0	0	0	0	112.1	C505	T472-C505 HydrophobicContact CG2-CB 4Å
473	T	92.1	Very high	78.7	Confident	110 Å²	110	86.7 Å²	86.7	68%	0.675	49%	0.485	S	S	*	.	S	Bend	trans	-104.4	128	-174.7	-56.7	0	0	0	0	110.6	S475	T473-S475 PolarHBondContact O-N 3.38Å
474	L	95.3	Very high	81.3	Confident	26 Å²	26	86.5 Å²	86.5	14%	0.136	48%	0.475	C	S	.	.			trans	-85.8	112.4	179.6	-61.1	176.3	0	0	0	111.6	H478 V504 S510 Q513 L514 W517	L474-H478 HydrophobicContact CB-CB 4.39Å; L474-H478 HydrophobicContact CD2-CB 4.09Å; L474-V504 HydrophobicContact CD2-CB 4.43Å; L474-V504 HydrophobicContact CD2-CG1 3.75Å; L474-V504 HydrophobicContact CD2-CG2 3.71Å; L474-S510 WeakPolarHBondContact CD1-O 3.41Å; L474-Q513 HydrophobicContact CD1-CB 3.86Å; L474-Q513 HydrophobicContact CD1-CG 3.83Å; L474-L514 HydrophobicContact CD1-CD1 4.43Å; L474-L514 HydrophobicContact CD1-CD2 4.37Å; L474-L514 HydrophobicContact CD1-CG 3.78Å; L474-W517 HydrophobicContact CB-CH2 3.56Å; L474-W517 HydrophobicContact CB-CZ2 4.3Å; L474-W517 HydrophobicContact CB-CZ3 4.18Å; L474-W517 HydrophobicContact CD1-CH2 3.93Å; L474-W517 HydrophobicContact CD1-CZ3 3.87Å; L474-W517 HydrophobicContact CG-CH2 4.36Å
475	S	95	Very high	83.6	Confident	57 Å²	57	81 Å²	81	40%	0.399	45%	0.447	S	S	.	.			trans	-75	170	171.3	73.6	0	0	0	0	114.5	T473 A477 H478 L479	T473-S475 PolarHBondContact O-N 3.38Å; S475-A477 PolarHBondContact O-N 3.19Å; S475-A477 PolarHBondContact OG-N 3.06Å; S475-H478 PolarHBondContact N-ND1 2.96Å; S475-H478 WeakPolarHBondContact O-CB 3.31Å; S475-H478 PolarHBondContact O-N 3.33Å; S475-H478 PolarHBondContact OG-ND1 3.26Å; S475-L479 PolarHBondContact O-N 2.99Å
476	A	95.6	Very high	85.8	Confident	72 Å²	72	75.5 Å²	75.5	60%	0.595	42%	0.418	S	S	*	.	H	α-helix	trans	-60	-24.8	172.9	0	0	0	0	0	113.5	L479 K480	A476-L479 PolarHBondContact O-N 3.45Å; A476-K480 PolarHBondContact O-N 3.14Å; A476-K480 VanDerWaalsContact O-N 3.14Å
477	A	95.3	Very high	88.1	Confident	65 Å²	65	73.9 Å²	73.9	54%	0.537	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-42.6	173.3	0	0	0	0	0	111.2	S475 L479 K480 K481	S475-A477 PolarHBondContact O-N 3.19Å; S475-A477 PolarHBondContact OG-N 3.06Å; A477-L479 VanDerWaalsContact C-N 3.31Å; A477-L479 PolarHBondContact O-N 3.32Å; A477-K480 PolarHBondContact O-N 3.43Å; A477-K481 WeakPolarHBondContact O-CB 3.49Å; A477-K481 PolarHBondContact O-N 3.4Å
478	H	96.5	Very high	90.6	Very high	14 Å²	14	74 Å²	74	7%	0.065	40%	0.395	C	S	.	.	H	α-helix	trans	-64.1	-35.9	174.7	-57.6	108.9	0	0	0	112.1	L474 S475 K481 A482 F501 E503 W517	L474-H478 HydrophobicContact CB-CB 4.39Å; L474-H478 HydrophobicContact CD2-CB 4.09Å; S475-H478 PolarHBondContact N-ND1 2.96Å; S475-H478 WeakPolarHBondContact O-CB 3.31Å; S475-H478 PolarHBondContact O-N 3.33Å; S475-H478 PolarHBondContact OG-ND1 3.26Å; H478-K481 PolarHBondContact O-N 2.79Å; H478-A482 WeakPolarHBondContact O-CB 3.34Å; H478-A482 PolarHBondContact O-N 3.21Å; H478-F501 HydrophobicContact CB-CE1 4.39Å; H478-E503 IonicContact CD2-OE1 3.69Å; H478-E503 PolarHBondContact CD2-OE1 3.05Å; H478-E503 WeakPolarHBondContact NE2-CG 3.39Å; H478-E503 IonicContact NE2-OE1 2.97Å; H478-W517 HydrophobicContact CB-CH2 4.35Å; H478-W517 HydrophobicContact CB-CZ3 4.17Å
479	L	97.5	Very high	92.3	Very high	65 Å²	65	69.5 Å²	69.5	34%	0.34	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-45.8	174.5	175	64.1	0	0	0	111.7	S475 A476 A477 K481 A482 K483 W517 F521	S475-L479 PolarHBondContact O-N 2.99Å; A476-L479 PolarHBondContact O-N 3.45Å; A477-L479 VanDerWaalsContact C-N 3.31Å; A477-L479 PolarHBondContact O-N 3.32Å; L479-K481 VanDerWaalsContact C-N 3.33Å; L479-K481 PolarHBondContact O-N 3.01Å; L479-A482 PolarHBondContact O-N 3.27Å; L479-K483 PolarHBondContact O-N 2.91Å; L479-W517 VanDerWaalsContact CA-CZ3 3.5Å; L479-W517 HydrophobicContact CB-CD2 4.45Å; L479-W517 HydrophobicContact CB-CE3 4.3Å; L479-W517 HydrophobicContact CB-CH2 3.72Å; L479-W517 HydrophobicContact CB-CZ2 3.91Å; L479-W517 HydrophobicContact CB-CZ3 3.96Å; L479-W517 HydrophobicContact CD1-CB 4.21Å; L479-W517 HydrophobicContact CD1-CD2 3.46Å; L479-W517 VanDerWaalsContact CD1-CD2 3.46Å; L479-W517 HydrophobicContact CD1-CE3 3.89Å; L479-W517 HydrophobicContact CD1-CG 3.61Å; L479-W517 HydrophobicContact CD1-CZ2 4.17Å; L479-W517 HydrophobicContact CD1-CZ3 4.4Å; L479-F521 HydrophobicContact CD1-CE1 4.21Å; L479-F521 HydrophobicContact CD1-CZ 3.66Å
480	K	96.9	Very high	93.8	Very high	157 Å²	157	71.6 Å²	71.6	68%	0.683	37%	0.372	S	S	*	.	H	α-helix	trans	-59.8	-45.3	175.6	-70.5	178.4	-179.4	-178.8	0	110.9	A476 A477 K483 M484	A476-K480 PolarHBondContact O-N 3.14Å; A476-K480 VanDerWaalsContact O-N 3.14Å; A477-K480 PolarHBondContact O-N 3.43Å; K480-K483 PolarHBondContact O-N 3.38Å; K480-M484 WeakPolarHBondContact O-CG 3.29Å; K480-M484 PolarHBondContact O-N 3.4Å
481	K	96.3	Very high	94.4	Very high	60 Å²	60	72.9 Å²	72.9	26%	0.261	37%	0.374	S	S	.	.	H	α-helix	trans	-63.1	-43.7	177.9	-175.1	170.5	176.7	-169.8	0	111.9	A477 H478 L479 K483 M484 M485 Y500 F501 E503	A477-K481 WeakPolarHBondContact O-CB 3.49Å; A477-K481 PolarHBondContact O-N 3.4Å; H478-K481 PolarHBondContact O-N 2.79Å; L479-K481 VanDerWaalsContact C-N 3.33Å; L479-K481 PolarHBondContact O-N 3.01Å; K481-K483 VanDerWaalsContact C-N 3.35Å; K481-K483 PolarHBondContact O-N 3.17Å; K481-M484 PolarHBondContact O-N 2.82Å; K481-M485 PolarHBondContact O-N 3.28Å; K481-Y500 HydrophobicContact CB-CE1 4.48Å; K481-Y500 HydrophobicContact CD-CD1 4.4Å; K481-Y500 HydrophobicContact CD-CE1 4.25Å; K481-Y500 WeakPolarHBondContact CE-O 3.44Å; K481-Y500 HydrophobicContact CG-CD1 3.79Å; K481-Y500 HydrophobicContact CG-CE1 3.32Å; K481-Y500 PolarHBondContact NZ-O 3.38Å; K481-Y500 WeakPolarHBondContact O-CE1 3.45Å; K481-F501 HydrophobicContact CB-CE1 3.86Å; K481-F501 HydrophobicContact CB-CZ 4.47Å; K481-F501 HydrophobicContact CD-CD1 3.93Å; K481-F501 HydrophobicContact CD-CE1 3.77Å; K481-F501 HydrophobicContact CG-CD1 4.25Å; K481-F501 HydrophobicContact CG-CE1 3.6Å; K481-F501 HydrophobicContact CG-CZ 4.18Å; K481-E503 IonicContact NZ-OE1 3.28Å; K481-E503 PolarHBondContact NZ-OE1 2.83Å; K481-E503 IonicContact NZ-OE2 2.75Å; K481-E503 PolarHBondContact NZ-OE2 3.2Å; K481-E503 VanDerWaalsContact NZ-OE2 3.17Å
482	A	96.6	Very high	94.6	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.5	-40.2	173.9	0	0	0	0	0	112.6	H478 L479 M485 F486 F501 L514 W517 F518 F521	H478-A482 WeakPolarHBondContact O-CB 3.34Å; H478-A482 PolarHBondContact O-N 3.21Å; L479-A482 PolarHBondContact O-N 3.27Å; A482-M485 WeakPolarHBondContact O-CB 3.35Å; A482-M485 PolarHBondContact O-N 2.91Å; A482-F486 WeakPolarHBondContact O-CB 3.36Å; A482-F486 PolarHBondContact O-N 3.47Å; A482-F501 HydrophobicContact CB-CZ 3.83Å; A482-L514 HydrophobicContact CB-CD2 4.06Å; A482-W517 HydrophobicContact CB-CE3 3.97Å; A482-W517 HydrophobicContact CB-CZ3 4.44Å; A482-F518 HydrophobicContact CB-CE2 3.94Å; A482-F521 HydrophobicContact CB-CE2 4.22Å
483	K	96.9	Very high	94.9	Very high	120 Å²	120	71.3 Å²	71.3	52%	0.522	37%	0.365	S	S	.	.	H	α-helix	trans	-63.6	-42.2	175.7	-172	176	179.8	177.7	0	111.8	L479 K480 K481 F486 M487 F521	L479-K483 PolarHBondContact O-N 2.91Å; K480-K483 PolarHBondContact O-N 3.38Å; K481-K483 VanDerWaalsContact C-N 3.35Å; K481-K483 PolarHBondContact O-N 3.17Å; K483-F486 PolarHBondContact O-N 2.9Å; K483-M487 PolarHBondContact O-N 3.39Å; K483-F521 HydrophobicContact CB-CE1 4.17Å; K483-F521 HydrophobicContact CB-CE2 4.01Å; K483-F521 HydrophobicContact CB-CZ 3.67Å; K483-F521 HydrophobicContact CD-CE1 4.44Å; K483-F521 HydrophobicContact CG-CE1 4.2Å; K483-F521 HydrophobicContact CG-CZ 4.18Å
484	M	96.1	Very high	94.9	Very high	83 Å²	83	68.9 Å²	68.9	41%	0.409	35%	0.352	S	S	.	.	H	α-helix	trans	-62	-48.5	174.2	-67.9	-57.2	-63.1	0	0	110.8	K480 K481 F486 M487 Y488	K480-M484 WeakPolarHBondContact O-CG 3.29Å; K480-M484 PolarHBondContact O-N 3.4Å; K481-M484 PolarHBondContact O-N 2.82Å; M484-F486 VanDerWaalsContact C-N 3.26Å; M484-F486 PolarHBondContact O-N 3.48Å; M484-M487 WeakPolarHBondContact O-CB 3.2Å; M484-M487 PolarHBondContact O-N 2.7Å; M484-Y488 WeakPolarHBondContact O-CD2 3.42Å
485	M	95.2	Very high	94.9	Very high	5 Å²	5	71.4 Å²	71.4	3%	0.025	37%	0.372	C	S	.	.	H	α-helix	trans	-54.7	-41.5	175.7	-167.8	-170.3	-175.2	0	0	112.7	K481 A482 M487 Y488 S489 P492 L496 L497 Y500 F501 F518	K481-M485 PolarHBondContact O-N 3.28Å; A482-M485 WeakPolarHBondContact O-CB 3.35Å; A482-M485 PolarHBondContact O-N 2.91Å; M485-M487 PolarHBondContact O-N 2.83Å; M485-Y488 PolarHBondContact O-N 3.41Å; M485-S489 PolarHBondContact O-N 3.11Å; M485-P492 HydrophobicContact CE-CB 3.43Å; M485-P492 VanDerWaalsContact CE-CB 3.43Å; M485-P492 HydrophobicContact CE-CG 4.15Å; M485-P492 HydrophobicContact SD-CB 4.36Å; M485-L496 HydrophobicContact CE-CB 4.11Å; M485-L496 HydrophobicContact CE-CD2 3.83Å; M485-L496 HydrophobicContact CE-CG 3.51Å; M485-L497 HydrophobicContact CE-CD2 3.88Å; M485-L497 HydrophobicContact CE-CG 4.23Å; M485-L497 HydrophobicContact SD-CD2 3.7Å; M485-Y500 HydrophobicContact CB-CD1 3.89Å; M485-Y500 HydrophobicContact CB-CE1 3.61Å; M485-Y500 HydrophobicContact CE-CG 4.29Å; M485-Y500 HydrophobicContact CG-CD1 3.93Å; M485-Y500 HydrophobicContact CG-CD2 4.48Å; M485-Y500 HydrophobicContact CG-CE1 4.08Å; M485-Y500 HydrophobicContact CG-CG 4.14Å; M485-Y500 HydrophobicContact SD-CD1 3.81Å; M485-Y500 HydrophobicContact SD-CE1 4.48Å; M485-Y500 HydrophobicContact SD-CG 3.98Å; M485-F501 HydrophobicContact SD-CE2 3.82Å; M485-F501 HydrophobicContact SD-CZ 4.5Å; M485-F518 HydrophobicContact CB-CZ 4.28Å; M485-F518 HydrophobicContact CG-CZ 4.29Å; M485-F518 HydrophobicContact SD-CZ 3.78Å
486	F	95.4	Very high	94.8	Very high	17 Å²	17	71.9 Å²	71.9	8%	0.075	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-29.1	179.2	178.6	-101.2	0	0	0	113.2	A482 K483 M484 Y488 S489 R490 F518 F521 R522	A482-F486 WeakPolarHBondContact O-CB 3.36Å; A482-F486 PolarHBondContact O-N 3.47Å; K483-F486 PolarHBondContact O-N 2.9Å; M484-F486 VanDerWaalsContact C-N 3.26Å; M484-F486 PolarHBondContact O-N 3.48Å; F486-Y488 VanDerWaalsContact C-N 3.28Å; F486-Y488 PolarHBondContact O-N 3.4Å; F486-S489 WeakPolarHBondContact CA-O 3.27Å; F486-S489 CarbonylContact O-C 3.45Å; F486-R490 HydrophobicContact CE2-CB 4.24Å; F486-R490 HydrophobicContact CE2-CG 4.34Å; F486-R490 HydrophobicContact CZ-CG 4.38Å; F486-F518 HydrophobicContact CB-CD1 4.33Å; F486-F518 HydrophobicContact CB-CE1 3.9Å; F486-F518 HydrophobicContact CB-CZ 4.46Å; F486-F518 AromaticContact CD2-CD1 3.65Å; F486-F518 HydrophobicContact CD2-CD1 3.65Å; F486-F518 AromaticContact CD2-CE1 3.97Å; F486-F518 HydrophobicContact CD2-CE1 3.97Å; F486-F518 HydrophobicContact CG-CD1 4.45Å; F486-F518 HydrophobicContact CG-CE1 4.45Å; F486-F521 HydrophobicContact CB-CB 4.43Å; F486-F521 HydrophobicContact CB-CD2 3.73Å; F486-F521 HydrophobicContact CB-CE2 4.43Å; F486-F521 HydrophobicContact CB-CG 4.46Å; F486-F521 HydrophobicContact CD1-CB 3.36Å; F486-F521 HydrophobicContact CD1-CD2 4.23Å; F486-F521 HydrophobicContact CD1-CG 4.12Å; F486-F521 HydrophobicContact CD2-CB 3.92Å; F486-F521 HydrophobicContact CD2-CD2 4.3Å; F486-F521 VanDerWaalsContact CE1-C 3.49Å; F486-F521 HydrophobicContact CE1-CB 3.44Å; F486-F521 VanDerWaalsContact CE1-CB 3.44Å; F486-F521 WeakPolarHBondContact CE1-O 3.41Å; F486-F521 HydrophobicContact CE2-CB 3.97Å; F486-F521 HydrophobicContact CG-CB 3.62Å; F486-F521 AromaticContact CG-CD2 3.82Å; F486-F521 HydrophobicContact CG-CD2 3.82Å; F486-F521 HydrophobicContact CG-CG 4.15Å; F486-F521 HydrophobicContact CZ-CB 3.75Å; F486-F521 WeakPolarHBondContact CZ-O 3.03Å; F486-R522 HydrophobicContact CE2-CG 3.61Å; F486-R522 HydrophobicContact CZ-CB 4.34Å; F486-R522 HydrophobicContact CZ-CG 3.79Å
487	M	93.2	Very high	94.8	Very high	105 Å²	105	69.6 Å²	69.6	52%	0.517	35%	0.347	S	S	.	.	H	α-helix	trans	-66.5	-30.8	174.1	-57.2	-70.3	93.9	0	0	112.1	K483 M484 M485	K483-M487 PolarHBondContact O-N 3.39Å; M484-M487 WeakPolarHBondContact O-CB 3.2Å; M484-M487 PolarHBondContact O-N 2.7Å; M485-M487 PolarHBondContact O-N 2.83Å
488	Y	93.3	Very high	94.7	Very high	86 Å²	86	71.9 Å²	71.9	34%	0.337	35%	0.345	S	S	.	.	H	α-helix	trans	-90.4	-35.1	178.4	-58.1	-82.8	0	0	0	112.7	E116 I120 M484 M485 F486	E116-Y488 HydrophobicContact CB-CE1 3.93Å; E116-Y488 VanDerWaalsContact CB-OH 3.25Å; E116-Y488 WeakPolarHBondContact CB-OH 3.48Å; E116-Y488 PolarHBondContact OE2-OH 3.17Å; I120-Y488 HydrophobicContact CD1-CD1 3.6Å; I120-Y488 HydrophobicContact CD1-CE1 3.03Å; I120-Y488 HydrophobicContact CD1-CE2 4.26Å; I120-Y488 HydrophobicContact CD1-CG 4.42Å; I120-Y488 VanDerWaalsContact CD1-CZ 3.41Å; I120-Y488 HydrophobicContact CG1-CD1 3.54Å; I120-Y488 HydrophobicContact CG1-CE1 3.32Å; M484-Y488 WeakPolarHBondContact O-CD2 3.42Å; M485-Y488 PolarHBondContact O-N 3.41Å; F486-Y488 VanDerWaalsContact C-N 3.28Å; F486-Y488 PolarHBondContact O-N 3.4Å
489	S	92.9	Very high	94.6	Very high	30 Å²	30	75.1 Å²	75.1	21%	0.21	37%	0.369	C	S	.	.			trans	-139.4	109.7	-178.5	-173	0	0	0	0	111.2	M485 F486 Y491 P492	M485-S489 PolarHBondContact O-N 3.11Å; F486-S489 WeakPolarHBondContact CA-O 3.27Å; F486-S489 CarbonylContact O-C 3.45Å; S489-Y491 VanDerWaalsContact C-N 3.25Å; S489-Y491 PolarHBondContact O-N 3.3Å; S489-P492 WeakPolarHBondContact OG-CA 3.23Å
490	R	92.7	Very high	94.5	Very high	169 Å²	169	75.5 Å²	75.5	64%	0.638	37%	0.367	S	S	*	.	S	Bend	trans	-67.9	-26.3	178	-66.6	-164.7	-75	175.2	-5.2	113.1	F486	F486-R490 HydrophobicContact CE2-CB 4.24Å; F486-R490 HydrophobicContact CE2-CG 4.34Å; F486-R490 HydrophobicContact CZ-CG 4.38Å
491	Y	94	Very high	94.4	Very high	155 Å²	155	68 Å²	68	61%	0.608	33%	0.334	S	S	*	.	S	Bend	trans	-136.9	71.5	-177.6	-58.2	-78.4	0	0	0	109.4	S489 T493	S489-Y491 VanDerWaalsContact C-N 3.25Å; S489-Y491 PolarHBondContact O-N 3.3Å; Y491-T493 PolarHBondContact O-N 2.85Å
492	P	93.1	Very high	94.3	Very high	21 Å²	21	68 Å²	68	14%	0.136	34%	0.341	C	S	.	.			trans	-67.4	138	-178	31.2	-37.2	0	0	0	110.4	M485 S489 L496 L497 F518	M485-P492 HydrophobicContact CE-CB 3.43Å; M485-P492 VanDerWaalsContact CE-CB 3.43Å; M485-P492 HydrophobicContact CE-CG 4.15Å; M485-P492 HydrophobicContact SD-CB 4.36Å; S489-P492 WeakPolarHBondContact OG-CA 3.23Å; P492-L496 HydrophobicContact CB-CB 4.46Å; P492-L496 HydrophobicContact CB-CD2 3.98Å; P492-L497 HydrophobicContact CB-CD2 4.38Å; P492-L497 HydrophobicContact CB-CG 4.17Å; P492-L497 HydrophobicContact CG-CD1 4.38Å; P492-L497 HydrophobicContact CG-CD2 3.96Å; P492-L497 HydrophobicContact CG-CG 4.03Å; P492-F518 VanDerWaalsContact CD-CE1 3.48Å; P492-F518 HydrophobicContact CG-CD1 3.85Å; P492-F518 HydrophobicContact CG-CE1 3.36Å; P492-F518 HydrophobicContact CG-CE2 4.47Å; P492-F518 HydrophobicContact CG-CZ 3.71Å
493	T	93.8	Very high	94.2	Very high	81 Å²	81	70.6 Å²	70.6	50%	0.497	35%	0.352	S	S	.	.			trans	-66.2	160.2	171.6	60.1	0	0	0	0	110.4	Y491 S495 L496 L497	Y491-T493 PolarHBondContact O-N 2.85Å; T493-S495 PolarHBondContact O-N 2.8Å; T493-S495 PolarHBondContact OG1-OG 2.94Å; T493-L496 PolarHBondContact O-N 3.2Å; T493-L496 VanDerWaalsContact O-N 3.15Å; T493-L496 WeakPolarHBondContact OG1-CB 3.36Å; T493-L496 PolarHBondContact OG1-N 3.11Å; T493-L497 PolarHBondContact O-N 2.94Å
494	S	92	Very high	94.1	Very high	59 Å²	59	65.1 Å²	65.1	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-59.1	-34.2	175.3	59.3	0	0	0	0	112.6	K498	S494-K498 WeakPolarHBondContact O-CG 3.46Å; S494-K498 PolarHBondContact O-N 3.48Å; S494-K498 VanDerWaalsContact O-N 3.09Å
495	S	93.9	Very high	94	Very high	78 Å²	78	63.5 Å²	63.5	55%	0.545	33%	0.326	S	S	.	.	H	α-helix	trans	-65.6	-43.8	174.7	57.7	0	0	0	0	112.1	T493 K498 S499	T493-S495 PolarHBondContact O-N 2.8Å; T493-S495 PolarHBondContact OG1-OG 2.94Å; S495-K498 PolarHBondContact O-N 3.27Å; S495-S499 PolarHBondContact O-N 2.82Å; S495-S499 PolarHBondContact O-OG 3.13Å
496	L	94.5	Very high	93.9	Very high	67 Å²	67	65 Å²	65	35%	0.351	33%	0.332	S	S	.	.	H	α-helix	trans	-67.2	-38.1	178.7	-170.5	65.1	0	0	0	111.6	M485 P492 T493 S499 Y500	M485-L496 HydrophobicContact CE-CB 4.11Å; M485-L496 HydrophobicContact CE-CD2 3.83Å; M485-L496 HydrophobicContact CE-CG 3.51Å; P492-L496 HydrophobicContact CB-CB 4.46Å; P492-L496 HydrophobicContact CB-CD2 3.98Å; T493-L496 PolarHBondContact O-N 3.2Å; T493-L496 VanDerWaalsContact O-N 3.15Å; T493-L496 WeakPolarHBondContact OG1-CB 3.36Å; T493-L496 PolarHBondContact OG1-N 3.11Å; L496-S499 PolarHBondContact O-OG 3.22Å; L496-Y500 VanDerWaalsContact O-CB 3.23Å; L496-Y500 WeakPolarHBondContact O-CB 3.29Å; L496-Y500 PolarHBondContact O-N 3.12Å
497	L	95	Very high	93.8	Very high	24 Å²	24	66.7 Å²	66.7	13%	0.126	34%	0.342	C	S	.	.	H	α-helix	trans	-61.1	-46.9	172.2	-75.2	169.8	0	0	0	111.2	M485 P492 T493 S499 Y500 F501 F506 F518	M485-L497 HydrophobicContact CE-CD2 3.88Å; M485-L497 HydrophobicContact CE-CG 4.23Å; M485-L497 HydrophobicContact SD-CD2 3.7Å; P492-L497 HydrophobicContact CB-CD2 4.38Å; P492-L497 HydrophobicContact CB-CG 4.17Å; P492-L497 HydrophobicContact CG-CD1 4.38Å; P492-L497 HydrophobicContact CG-CD2 3.96Å; P492-L497 HydrophobicContact CG-CG 4.03Å; T493-L497 PolarHBondContact O-N 2.94Å; L497-S499 VanDerWaalsContact C-N 3.35Å; L497-S499 PolarHBondContact O-N 3.35Å; L497-Y500 PolarHBondContact O-N 3.4Å; L497-F501 HydrophobicContact CD2-CD2 4.26Å; L497-F501 HydrophobicContact CD2-CE2 3.91Å; L497-F501 VanDerWaalsContact O-CD2 3.27Å; L497-F501 WeakPolarHBondContact O-CD2 3.47Å; L497-F501 PolarHBondContact O-N 3.14Å; L497-F506 HydrophobicContact CB-CE1 4.03Å; L497-F506 HydrophobicContact CB-CZ 4.03Å; L497-F506 WeakPolarHBondContact O-CZ 3.25Å; L497-F518 HydrophobicContact CD2-CE2 4.03Å; L497-F518 HydrophobicContact CD2-CZ 4.18Å
498	K	93.9	Very high	93.9	Very high	113 Å²	113	72.6 Å²	72.6	49%	0.491	36%	0.358	S	S	.	.	H	α-helix	trans	-63.7	-38.3	-179.8	-75	174.5	179.9	178.1	0	113	S494 S495 F501 F506	S494-K498 WeakPolarHBondContact O-CG 3.46Å; S494-K498 PolarHBondContact O-N 3.48Å; S494-K498 VanDerWaalsContact O-N 3.09Å; S495-K498 PolarHBondContact O-N 3.27Å; K498-F501 CarbonylContact O-C 3.55Å; K498-F506 HydrophobicContact CB-CE2 4.22Å; K498-F506 HydrophobicContact CG-CD2 3.74Å; K498-F506 HydrophobicContact CG-CE2 3.73Å; K498-F506 HydrophobicContact CG-CG 4.31Å; K498-F506 HydrophobicContact CG-CZ 4.26Å
499	S	93.8	Very high	94	Very high	82 Å²	82	70.8 Å²	70.8	57%	0.573	37%	0.366	S	S	*	.	H	α-helix	trans	-72.9	-34.9	176.3	65.8	0	0	0	0	112.3	S495 L496 L497	S495-S499 PolarHBondContact O-N 2.82Å; S495-S499 PolarHBondContact O-OG 3.13Å; L496-S499 PolarHBondContact O-OG 3.22Å; L497-S499 VanDerWaalsContact C-N 3.35Å; L497-S499 PolarHBondContact O-N 3.35Å
500	Y	95.1	Very high	94.1	Very high	73 Å²	73	69.6 Å²	69.6	29%	0.286	36%	0.357	S	S	.	.	H	α-helix	trans	-73.8	-32.3	178.7	-154	-105.3	0	0	0	111.9	K481 M485 L496 L497 P502	K481-Y500 HydrophobicContact CB-CE1 4.48Å; K481-Y500 HydrophobicContact CD-CD1 4.4Å; K481-Y500 HydrophobicContact CD-CE1 4.25Å; K481-Y500 WeakPolarHBondContact CE-O 3.44Å; K481-Y500 HydrophobicContact CG-CD1 3.79Å; K481-Y500 HydrophobicContact CG-CE1 3.32Å; K481-Y500 PolarHBondContact NZ-O 3.38Å; K481-Y500 WeakPolarHBondContact O-CE1 3.45Å; M485-Y500 HydrophobicContact CB-CD1 3.89Å; M485-Y500 HydrophobicContact CB-CE1 3.61Å; M485-Y500 HydrophobicContact CE-CG 4.29Å; M485-Y500 HydrophobicContact CG-CD1 3.93Å; M485-Y500 HydrophobicContact CG-CD2 4.48Å; M485-Y500 HydrophobicContact CG-CE1 4.08Å; M485-Y500 HydrophobicContact CG-CG 4.14Å; M485-Y500 HydrophobicContact SD-CD1 3.81Å; M485-Y500 HydrophobicContact SD-CE1 4.48Å; M485-Y500 HydrophobicContact SD-CG 3.98Å; L496-Y500 VanDerWaalsContact O-CB 3.23Å; L496-Y500 WeakPolarHBondContact O-CB 3.29Å; L496-Y500 PolarHBondContact O-N 3.12Å; L497-Y500 PolarHBondContact O-N 3.4Å; Y500-P502 VanDerWaalsContact O-CD 3.23Å; Y500-P502 WeakPolarHBondContact O-CD 3.33Å
501	F	95.3	Very high	94.2	Very high	1 Å²	1	63 Å²	63	0%	0.004	34%	0.336	C	S	.	.			trans	-116.6	65.2	179.5	-58.4	-80.1	0	0	0	112.7	H478 K481 A482 M485 L497 K498 E503 V504 F506 L514	H478-F501 HydrophobicContact CB-CE1 4.39Å; K481-F501 HydrophobicContact CB-CE1 3.86Å; K481-F501 HydrophobicContact CB-CZ 4.47Å; K481-F501 HydrophobicContact CD-CD1 3.93Å; K481-F501 HydrophobicContact CD-CE1 3.77Å; K481-F501 HydrophobicContact CG-CD1 4.25Å; K481-F501 HydrophobicContact CG-CE1 3.6Å; K481-F501 HydrophobicContact CG-CZ 4.18Å; A482-F501 HydrophobicContact CB-CZ 3.83Å; M485-F501 HydrophobicContact SD-CE2 3.82Å; M485-F501 HydrophobicContact SD-CZ 4.5Å; L497-F501 HydrophobicContact CD2-CD2 4.26Å; L497-F501 HydrophobicContact CD2-CE2 3.91Å; L497-F501 VanDerWaalsContact O-CD2 3.27Å; L497-F501 WeakPolarHBondContact O-CD2 3.47Å; L497-F501 PolarHBondContact O-N 3.14Å; K498-F501 CarbonylContact O-C 3.55Å; F501-E503 PolarHBondContact O-N 3.42Å; F501-V504 HydrophobicContact CB-CB 3.95Å; F501-V504 HydrophobicContact CB-CG2 3.81Å; F501-V504 HydrophobicContact CD1-CG2 4.37Å; F501-V504 HydrophobicContact CG-CG2 4.41Å; F501-V504 PolarHBondContact O-N 3.39Å; F501-V504 VanDerWaalsContact O-N 3.12Å; F501-F506 HydrophobicContact CB-CE2 4.25Å; F501-F506 HydrophobicContact CB-CZ 4Å; F501-F506 HydrophobicContact CD2-CZ 4.33Å; F501-L514 HydrophobicContact CE2-CD2 4.06Å; F501-L514 HydrophobicContact CZ-CD2 4.12Å
502	P	94.3	Very high	94.3	Very high	60 Å²	60	58.3 Å²	58.3	39%	0.39	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-26.5	179.9	26.8	-36.1	0	0	0	113.1	Y500 V504	Y500-P502 VanDerWaalsContact O-CD 3.23Å; Y500-P502 WeakPolarHBondContact O-CD 3.33Å; P502-V504 VanDerWaalsContact C-N 3.28Å; P502-V504 PolarHBondContact O-N 3.47Å
503	E	94.6	Very high	94.4	Very high	53 Å²	53	61 Å²	61	25%	0.248	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.5	178.4	71.2	-80.4	-170.9	0	0	114.3	K470 T471 H478 K481 F501	K470-E503 CarbonylContact C-O 3.53Å; K470-E503 WeakPolarHBondContact CA-O 3.24Å; T471-E503 PolarHBondContact N-O 3.03Å; T471-E503 PolarHBondContact OG1-O 3.27Å; T471-E503 VanDerWaalsContact OG1-O 3.11Å; H478-E503 IonicContact CD2-OE1 3.69Å; H478-E503 PolarHBondContact CD2-OE1 3.05Å; H478-E503 WeakPolarHBondContact NE2-CG 3.39Å; H478-E503 IonicContact NE2-OE1 2.97Å; K481-E503 IonicContact NZ-OE1 3.28Å; K481-E503 PolarHBondContact NZ-OE1 2.83Å; K481-E503 IonicContact NZ-OE2 2.75Å; K481-E503 PolarHBondContact NZ-OE2 3.2Å; K481-E503 VanDerWaalsContact NZ-OE2 3.17Å; F501-E503 PolarHBondContact O-N 3.42Å
504	V	94.1	Very high	94.5	Very high	6 Å²	6	57.2 Å²	57.2	4%	0.036	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-102	128.6	-175.9	175.9	0	0	0	0	110.7	T471 L474 F501 P502 F506	T471-V504 WeakPolarHBondContact O-CA 3.24Å; L474-V504 HydrophobicContact CD2-CB 4.43Å; L474-V504 HydrophobicContact CD2-CG1 3.75Å; L474-V504 HydrophobicContact CD2-CG2 3.71Å; F501-V504 HydrophobicContact CB-CB 3.95Å; F501-V504 HydrophobicContact CB-CG2 3.81Å; F501-V504 HydrophobicContact CD1-CG2 4.37Å; F501-V504 HydrophobicContact CG-CG2 4.41Å; F501-V504 PolarHBondContact O-N 3.39Å; F501-V504 VanDerWaalsContact O-N 3.12Å; P502-V504 VanDerWaalsContact C-N 3.28Å; P502-V504 PolarHBondContact O-N 3.47Å; V504-F506 HydrophobicContact CB-CE2 4.25Å; V504-F506 HydrophobicContact CG1-CD2 4.4Å; V504-F506 HydrophobicContact CG1-CE2 4.33Å; V504-F506 WeakPolarHBondContact O-CD2 3.42Å; V504-F506 PolarHBondContact O-N 3.46Å
505	C	93.3	Very high	94.7	Very high	49 Å²	49	58.5 Å²	58.5	33%	0.331	32%	0.322	S	S	.	.			trans	-80.7	108.5	164	-167.9	0	0	0	0	108.9	K470 T471 T472 N507 S510	K470-C505 HydrophobicContact CB-CB 3.87Å; T471-C505 PolarHBondContact O-N 3.2Å; T472-C505 HydrophobicContact CG2-CB 4Å; C505-N507 PolarHBondContact O-N 2.83Å; C505-N507 VanDerWaalsContact O-N 3.11Å; C505-S510 PolarHBondContact O-OG 3.09Å
506	F	93.7	Very high	94.8	Very high	36 Å²	36	60.6 Å²	60.6	16%	0.158	32%	0.321	C	S	.	.			trans	-72	104.2	177.8	-73.3	-91.6	0	0	0	110.3	L497 K498 F501 V504 L514	L497-F506 HydrophobicContact CB-CE1 4.03Å; L497-F506 HydrophobicContact CB-CZ 4.03Å; L497-F506 WeakPolarHBondContact O-CZ 3.25Å; K498-F506 HydrophobicContact CB-CE2 4.22Å; K498-F506 HydrophobicContact CG-CD2 3.74Å; K498-F506 HydrophobicContact CG-CE2 3.73Å; K498-F506 HydrophobicContact CG-CG 4.31Å; K498-F506 HydrophobicContact CG-CZ 4.26Å; F501-F506 HydrophobicContact CB-CE2 4.25Å; F501-F506 HydrophobicContact CB-CZ 4Å; F501-F506 HydrophobicContact CD2-CZ 4.33Å; V504-F506 HydrophobicContact CB-CE2 4.25Å; V504-F506 HydrophobicContact CG1-CD2 4.4Å; V504-F506 HydrophobicContact CG1-CE2 4.33Å; V504-F506 WeakPolarHBondContact O-CD2 3.42Å; V504-F506 PolarHBondContact O-N 3.46Å; F506-L514 HydrophobicContact CD1-CD1 4.31Å; F506-L514 HydrophobicContact CE1-CD1 3.51Å; F506-L514 HydrophobicContact CZ-CD1 4.22Å
507	N	93.3	Very high	94.9	Very high	52 Å²	52	58.6 Å²	58.6	28%	0.278	31%	0.309	S	S	.	.			trans	-117.2	177.8	170.9	66.9	35.7	0	0	0	109.1	C505 G509 S510 T511	C505-N507 PolarHBondContact O-N 2.83Å; C505-N507 VanDerWaalsContact O-N 3.11Å; N507-G509 PolarHBondContact O-N 3.16Å; N507-G509 WeakPolarHBondContact OD1-CA 3.28Å; N507-G509 PolarHBondContact OD1-N 3.45Å; N507-S510 PolarHBondContact N-OG 3.46Å; N507-S510 PolarHBondContact O-OG 3.11Å; N507-S510 PolarHBondContact OD1-N 3.34Å; N507-S510 PolarHBondContact OD1-OG 2.87Å; N507-T511 WeakPolarHBondContact O-CB 2.83Å; N507-T511 PolarHBondContact O-N 3.04Å; N507-T511 PolarHBondContact O-OG1 3.4Å
508	R	94.3	Very high	95	Very high	230 Å²	230	57.8 Å²	57.8	87%	0.868	30%	0.304	S	S	*	.	H	α-helix	trans	-57.6	-38	-179.9	-173	175	179.8	161.8	0.3	112.5	A512	R508-A512 WeakPolarHBondContact O-CB 3.4Å; R508-A512 PolarHBondContact O-N 3Å
509	G	95.5	Very high	95	Very high	48 Å²	48	55.5 Å²	55.5	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-70.3	-51.8	-179.8	0	0	0	0	0	113.5	N507 T511 A512 Q513	N507-G509 PolarHBondContact O-N 3.16Å; N507-G509 WeakPolarHBondContact OD1-CA 3.28Å; N507-G509 PolarHBondContact OD1-N 3.45Å; G509-T511 VanDerWaalsContact C-N 3.34Å; G509-T511 PolarHBondContact O-N 2.78Å; G509-A512 PolarHBondContact O-N 3.03Å; G509-Q513 WeakPolarHBondContact O-CB 3.25Å; G509-Q513 PolarHBondContact O-N 2.81Å
510	S	95.6	Very high	95.1	Very high	4 Å²	4	57 Å²	57	3%	0.028	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-38.5	178.3	57.9	0	0	0	0	111.6	L474 C505 N507 Q513 L514	L474-S510 WeakPolarHBondContact CD1-O 3.41Å; C505-S510 PolarHBondContact O-OG 3.09Å; N507-S510 PolarHBondContact N-OG 3.46Å; N507-S510 PolarHBondContact O-OG 3.11Å; N507-S510 PolarHBondContact OD1-N 3.34Å; N507-S510 PolarHBondContact OD1-OG 2.87Å; S510-Q513 PolarHBondContact O-N 2.88Å; S510-L514 PolarHBondContact O-N 3.08Å
511	T	95.3	Very high	95.1	Very high	30 Å²	30	56 Å²	56	18%	0.184	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-50.1	174.1	-55.4	0	0	0	0	111.4	L427 N507 G509 Q513 L514 V515	L427-T511 HydrophobicContact CD1-CG2 3.59Å; N507-T511 WeakPolarHBondContact O-CB 2.83Å; N507-T511 PolarHBondContact O-N 3.04Å; N507-T511 PolarHBondContact O-OG1 3.4Å; G509-T511 VanDerWaalsContact C-N 3.34Å; G509-T511 PolarHBondContact O-N 2.78Å; T511-Q513 VanDerWaalsContact C-N 3.29Å; T511-Q513 PolarHBondContact O-N 3.22Å; T511-L514 PolarHBondContact O-N 2.9Å; T511-V515 WeakPolarHBondContact O-CG2 3.27Å; T511-V515 PolarHBondContact O-N 2.86Å
512	A	95.3	Very high	95.1	Very high	57 Å²	57	63.7 Å²	63.7	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-61.4	-38.4	179	0	0	0	0	0	112.2	R508 G509 V515 K516	R508-A512 WeakPolarHBondContact O-CB 3.4Å; R508-A512 PolarHBondContact O-N 3Å; G509-A512 PolarHBondContact O-N 3.03Å; A512-V515 PolarHBondContact O-N 3.04Å; A512-K516 WeakPolarHBondContact O-CB 3.45Å; A512-K516 PolarHBondContact O-N 2.82Å
513	Q	96.1	Very high	95.1	Very high	77 Å²	77	63.9 Å²	63.9	36%	0.36	33%	0.327	S	S	.	.	H	α-helix	trans	-66	-43.4	176.8	-174.8	74.9	0.7	0	0	111.9	L474 G509 S510 T511 K516 W517	L474-Q513 HydrophobicContact CD1-CB 3.86Å; L474-Q513 HydrophobicContact CD1-CG 3.83Å; G509-Q513 WeakPolarHBondContact O-CB 3.25Å; G509-Q513 PolarHBondContact O-N 2.81Å; S510-Q513 PolarHBondContact O-N 2.88Å; T511-Q513 VanDerWaalsContact C-N 3.29Å; T511-Q513 PolarHBondContact O-N 3.22Å; Q513-K516 WeakPolarHBondContact O-CB 3.23Å; Q513-K516 PolarHBondContact O-N 2.98Å; Q513-W517 HydrophobicContact CG-CD2 4.37Å; Q513-W517 HydrophobicContact CG-CH2 4.4Å; Q513-W517 HydrophobicContact CG-CZ2 3.77Å; Q513-W517 VanDerWaalsContact O-CG 3.29Å; Q513-W517 PolarHBondContact O-N 3.41Å
514	L	96.6	Very high	95.2	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-49	172.3	-80.2	166.1	0	0	0	110.7	L474 A482 F501 F506 S510 T511 K516 W517 F518	L474-L514 HydrophobicContact CD1-CD1 4.43Å; L474-L514 HydrophobicContact CD1-CD2 4.37Å; L474-L514 HydrophobicContact CD1-CG 3.78Å; A482-L514 HydrophobicContact CB-CD2 4.06Å; F501-L514 HydrophobicContact CE2-CD2 4.06Å; F501-L514 HydrophobicContact CZ-CD2 4.12Å; F506-L514 HydrophobicContact CD1-CD1 4.31Å; F506-L514 HydrophobicContact CE1-CD1 3.51Å; F506-L514 HydrophobicContact CZ-CD1 4.22Å; S510-L514 PolarHBondContact O-N 3.08Å; T511-L514 PolarHBondContact O-N 2.9Å; L514-K516 VanDerWaalsContact C-N 3.28Å; L514-K516 PolarHBondContact O-N 3.36Å; L514-W517 HydrophobicContact CD2-CE3 3.84Å; L514-W517 HydrophobicContact CD2-CZ3 4.05Å; L514-W517 WeakPolarHBondContact O-CB 3.49Å; L514-W517 PolarHBondContact O-N 2.89Å; L514-F518 HydrophobicContact CD2-CE2 4.38Å; L514-F518 VanDerWaalsContact O-CD2 3.28Å; L514-F518 WeakPolarHBondContact O-CD2 3.4Å; L514-F518 PolarHBondContact O-N 2.82Å
515	V	94.5	Very high	95.2	Very high	86 Å²	86	67.7 Å²	67.7	52%	0.521	35%	0.348	S	S	.	.	H	α-helix	trans	-57.3	-42.3	177.6	172	0	0	0	0	111.3	T511 A512 F518 S519	T511-V515 WeakPolarHBondContact O-CG2 3.27Å; T511-V515 PolarHBondContact O-N 2.86Å; A512-V515 PolarHBondContact O-N 3.04Å; V515-F518 PolarHBondContact O-N 3.37Å; V515-S519 WeakPolarHBondContact O-CB 3.36Å; V515-S519 PolarHBondContact O-N 3.27Å
516	K	95.8	Very high	95.3	Very high	123 Å²	123	68.8 Å²	68.8	54%	0.535	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-44.4	174.4	-178.8	178.7	178.8	178	0	112	A512 Q513 L514 S519 N520	A512-K516 WeakPolarHBondContact O-CB 3.45Å; A512-K516 PolarHBondContact O-N 2.82Å; Q513-K516 WeakPolarHBondContact O-CB 3.23Å; Q513-K516 PolarHBondContact O-N 2.98Å; L514-K516 VanDerWaalsContact C-N 3.28Å; L514-K516 PolarHBondContact O-N 3.36Å; K516-S519 PolarHBondContact O-N 3.36Å; K516-N520 WeakPolarHBondContact O-CB 3.36Å; K516-N520 VanDerWaalsContact O-CG 3.25Å; K516-N520 PolarHBondContact O-N 3.02Å; K516-N520 PolarHBondContact O-OD1 3.28Å
517	W	97.5	Very high	95.4	Very high	25 Å²	25	70.8 Å²	70.8	10%	0.095	36%	0.361	C	S	.	.	H	α-helix	trans	-62.7	-48.3	175.9	-65.2	-18	0	0	0	111.9	L474 H478 L479 A482 Q513 L514 S519 N520 F521	L474-W517 HydrophobicContact CB-CH2 3.56Å; L474-W517 HydrophobicContact CB-CZ2 4.3Å; L474-W517 HydrophobicContact CB-CZ3 4.18Å; L474-W517 HydrophobicContact CD1-CH2 3.93Å; L474-W517 HydrophobicContact CD1-CZ3 3.87Å; L474-W517 HydrophobicContact CG-CH2 4.36Å; H478-W517 HydrophobicContact CB-CH2 4.35Å; H478-W517 HydrophobicContact CB-CZ3 4.17Å; L479-W517 VanDerWaalsContact CA-CZ3 3.5Å; L479-W517 HydrophobicContact CB-CD2 4.45Å; L479-W517 HydrophobicContact CB-CE3 4.3Å; L479-W517 HydrophobicContact CB-CH2 3.72Å; L479-W517 HydrophobicContact CB-CZ2 3.91Å; L479-W517 HydrophobicContact CB-CZ3 3.96Å; L479-W517 HydrophobicContact CD1-CB 4.21Å; L479-W517 HydrophobicContact CD1-CD2 3.46Å; L479-W517 VanDerWaalsContact CD1-CD2 3.46Å; L479-W517 HydrophobicContact CD1-CE3 3.89Å; L479-W517 HydrophobicContact CD1-CG 3.61Å; L479-W517 HydrophobicContact CD1-CZ2 4.17Å; L479-W517 HydrophobicContact CD1-CZ3 4.4Å; A482-W517 HydrophobicContact CB-CE3 3.97Å; A482-W517 HydrophobicContact CB-CZ3 4.44Å; Q513-W517 HydrophobicContact CG-CD2 4.37Å; Q513-W517 HydrophobicContact CG-CH2 4.4Å; Q513-W517 HydrophobicContact CG-CZ2 3.77Å; Q513-W517 VanDerWaalsContact O-CG 3.29Å; Q513-W517 PolarHBondContact O-N 3.41Å; L514-W517 HydrophobicContact CD2-CE3 3.84Å; L514-W517 HydrophobicContact CD2-CZ3 4.05Å; L514-W517 WeakPolarHBondContact O-CB 3.49Å; L514-W517 PolarHBondContact O-N 2.89Å; W517-S519 VanDerWaalsContact C-N 3.27Å; W517-S519 PolarHBondContact O-N 3.41Å; W517-N520 WeakPolarHBondContact O-CB 3.43Å; W517-N520 PolarHBondContact O-N 3.47Å; W517-N520 VanDerWaalsContact O-N 3.07Å; W517-F521 HydrophobicContact CB-CE2 3.96Å; W517-F521 HydrophobicContact CB-CZ 4.03Å; W517-F521 WeakPolarHBondContact O-CD1 3.42Å; W517-F521 VanDerWaalsContact O-CD2 3.23Å; W517-F521 WeakPolarHBondContact O-CD2 3.21Å; W517-F521 WeakPolarHBondContact O-CG 3.28Å; W517-F521 PolarHBondContact O-N 3.44Å
518	F	96.2	Very high	95.6	Very high	6 Å²	6	72.1 Å²	72.1	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-61.6	-36.3	176.9	-85.7	-98.2	0	0	0	112	A482 M485 F486 P492 L497 L514 V515 F521 R522	A482-F518 HydrophobicContact CB-CE2 3.94Å; M485-F518 HydrophobicContact CB-CZ 4.28Å; M485-F518 HydrophobicContact CG-CZ 4.29Å; M485-F518 HydrophobicContact SD-CZ 3.78Å; F486-F518 HydrophobicContact CB-CD1 4.33Å; F486-F518 HydrophobicContact CB-CE1 3.9Å; F486-F518 HydrophobicContact CB-CZ 4.46Å; F486-F518 AromaticContact CD2-CD1 3.65Å; F486-F518 HydrophobicContact CD2-CD1 3.65Å; F486-F518 AromaticContact CD2-CE1 3.97Å; F486-F518 HydrophobicContact CD2-CE1 3.97Å; F486-F518 HydrophobicContact CG-CD1 4.45Å; F486-F518 HydrophobicContact CG-CE1 4.45Å; P492-F518 VanDerWaalsContact CD-CE1 3.48Å; P492-F518 HydrophobicContact CG-CD1 3.85Å; P492-F518 HydrophobicContact CG-CE1 3.36Å; P492-F518 HydrophobicContact CG-CE2 4.47Å; P492-F518 HydrophobicContact CG-CZ 3.71Å; L497-F518 HydrophobicContact CD2-CE2 4.03Å; L497-F518 HydrophobicContact CD2-CZ 4.18Å; L514-F518 HydrophobicContact CD2-CE2 4.38Å; L514-F518 VanDerWaalsContact O-CD2 3.28Å; L514-F518 WeakPolarHBondContact O-CD2 3.4Å; L514-F518 PolarHBondContact O-N 2.82Å; V515-F518 PolarHBondContact O-N 3.37Å; F518-F521 PolarHBondContact O-N 3.34Å; F518-R522 WeakPolarHBondContact O-CG 3.41Å; F518-R522 PolarHBondContact O-N 3.19Å
519	S	94.4	Very high	95.7	Very high	66 Å²	66	60.8 Å²	60.8	46%	0.462	33%	0.331	S	S	.	.	H	α-helix	trans	-68	-33.6	173.5	-169.6	0	0	0	0	113	V515 K516 W517	V515-S519 WeakPolarHBondContact O-CB 3.36Å; V515-S519 PolarHBondContact O-N 3.27Å; K516-S519 PolarHBondContact O-N 3.36Å; W517-S519 VanDerWaalsContact C-N 3.27Å; W517-S519 PolarHBondContact O-N 3.41Å
520	N	96.2	Very high	95.7	Very high	112 Å²	112	61.8 Å²	61.8	60%	0.599	32%	0.318	S	S	*	.	H	α-helix	trans	-76.7	-24.7	176.2	-72.7	-7.7	0	0	0	112.9	K516 W517	K516-N520 WeakPolarHBondContact O-CB 3.36Å; K516-N520 VanDerWaalsContact O-CG 3.25Å; K516-N520 PolarHBondContact O-N 3.02Å; K516-N520 PolarHBondContact O-OD1 3.28Å; W517-N520 WeakPolarHBondContact O-CB 3.43Å; W517-N520 PolarHBondContact O-N 3.47Å; W517-N520 VanDerWaalsContact O-N 3.07Å
521	F	96.3	Very high	95.7	Very high	54 Å²	54	66.6 Å²	66.6	24%	0.237	34%	0.342	C	S	.	.	H	α-helix	trans	-80.7	-30.8	178.2	-58.5	-32.9	0	0	0	112.8	L479 A482 K483 F486 W517 F518	L479-F521 HydrophobicContact CD1-CE1 4.21Å; L479-F521 HydrophobicContact CD1-CZ 3.66Å; A482-F521 HydrophobicContact CB-CE2 4.22Å; K483-F521 HydrophobicContact CB-CE1 4.17Å; K483-F521 HydrophobicContact CB-CE2 4.01Å; K483-F521 HydrophobicContact CB-CZ 3.67Å; K483-F521 HydrophobicContact CD-CE1 4.44Å; K483-F521 HydrophobicContact CG-CE1 4.2Å; K483-F521 HydrophobicContact CG-CZ 4.18Å; F486-F521 HydrophobicContact CB-CB 4.43Å; F486-F521 HydrophobicContact CB-CD2 3.73Å; F486-F521 HydrophobicContact CB-CE2 4.43Å; F486-F521 HydrophobicContact CB-CG 4.46Å; F486-F521 HydrophobicContact CD1-CB 3.36Å; F486-F521 HydrophobicContact CD1-CD2 4.23Å; F486-F521 HydrophobicContact CD1-CG 4.12Å; F486-F521 HydrophobicContact CD2-CB 3.92Å; F486-F521 HydrophobicContact CD2-CD2 4.3Å; F486-F521 VanDerWaalsContact CE1-C 3.49Å; F486-F521 HydrophobicContact CE1-CB 3.44Å; F486-F521 VanDerWaalsContact CE1-CB 3.44Å; F486-F521 WeakPolarHBondContact CE1-O 3.41Å; F486-F521 HydrophobicContact CE2-CB 3.97Å; F486-F521 HydrophobicContact CG-CB 3.62Å; F486-F521 AromaticContact CG-CD2 3.82Å; F486-F521 HydrophobicContact CG-CD2 3.82Å; F486-F521 HydrophobicContact CG-CG 4.15Å; F486-F521 HydrophobicContact CZ-CB 3.75Å; F486-F521 WeakPolarHBondContact CZ-O 3.03Å; W517-F521 HydrophobicContact CB-CE2 3.96Å; W517-F521 HydrophobicContact CB-CZ 4.03Å; W517-F521 WeakPolarHBondContact O-CD1 3.42Å; W517-F521 VanDerWaalsContact O-CD2 3.23Å; W517-F521 WeakPolarHBondContact O-CD2 3.21Å; W517-F521 WeakPolarHBondContact O-CG 3.28Å; W517-F521 PolarHBondContact O-N 3.44Å; F518-F521 PolarHBondContact O-N 3.34Å
522	R	94.1	Very high	95.7	Very high	161 Å²	161	69.9 Å²	69.9	61%	0.608	36%	0.357	S	S	*	.			trans	-64.8	0	167.7	-67.3	173.6	-154.4	163	6.5	109.8	F486 F518	F486-R522 HydrophobicContact CE2-CG 3.61Å; F486-R522 HydrophobicContact CZ-CB 4.34Å; F486-R522 HydrophobicContact CZ-CG 3.79Å; F518-R522 WeakPolarHBondContact O-CG 3.41Å; F518-R522 PolarHBondContact O-N 3.19Å

Retrieved 522 of 522 residues in 283.5 ms (Link to these results)

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